diethyl-[2-[2,4,6-trimethyl-3-[(5Z,9Z,15Z,19Z)-10,15,20-tris[3-(2-diethylphosphanylethylsulfonyl)-2,4,6-trimethyl-phenyl]-21,22,23,24-tetrahydroporphyrin-5-yl]phenyl]sulfonylethyl]phosphane

Systemtic Name: diethyl-[2-[2,4,6-trimethyl-3-[(5Z,9Z,15Z,19Z)-10,15,20-tris[3-(2-diethylphosphanylethylsulfonyl)-2,4,6-trimethyl-phenyl]-21,22,23,24-tetrahydroporphyrin-5-yl]phenyl]sulfonylethyl]phosphane Openeye Name: diethyl-[2-[2,4,6-trimethyl-3-[(5Z,9Z,15Z,19Z)-10,15,20-tris[3-(2-diethylphosphanylethylsulfonyl)-2,4,6-trimethyl-phenyl]-21,22,23,24-tetrahydroporphyrin-5-yl]phenyl]sulfonylethyl]phosphane CAS Name: diethyl-[2-[2,4,6-trimethyl-3-[(5Z,9Z,15Z,19Z)-10,15,20-tris[3-(2-diethylphosphinoethylsulfonyl)-2,4,6-trimethylphenyl]-21,22,23,24-tetrahydroporphyrin-5-yl]phenyl]sulfonylethyl]phosphine IUPAC Name: diethyl-[2-[2,4,6-trimethyl-3-[(5Z,9Z,15Z,19Z)-10,15,20-tris[3-(2-diethylphosphanylethylsulfonyl)-2,4,6-trimethylphenyl]-21,22,23,24-tetrahydroporphyrin-5-yl]phenyl]sulfonylethyl]phosphane Traditional Name: diethyl-[2-[2,4,6-trimethyl-3-[(5Z,9Z,15Z,19Z)-10,15,20-tris[3-(2-diethylphosphinoethylsulfonyl)-2,4,6-trimethyl-phenyl]-21,22,23,24-tetrahydroporphin-5-yl]phenyl]sulfonylethyl]phosphine Formula: C80H108N4O8P4S4 MolecularWeight: 1505.890564

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Descriptors Computed from Structure

Canonical SMILES:

CCP(CC)CCS(=O)(=O)C1=C(C=C(C(=C1C)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=C(C6=CC=C2N6)C7=C(C(=C(C=C7C)C)S(=O)(=O)CCP(CC)CC)C)N5)C8=C(C(=C(C=C8C)C)S(=O)(=O)CCP(CC)CC)C)C9=C(C(=C(C=C9C)C)S(=O)(=O)CCP(CC)CC)C)N3)C)C

Isomeric SMILES

CCP(CCS(=O)(=O)C1=C(C=C(C(=C1C)/C/2=C\3/N/C(=C(\C4=CC=C(N4)/C(=C/5\N/C(=C(\C6=CC=C2N6)/C7=C(C(=C(C=C7C)C)S(=O)(=O)CCP(CC)CC)C)/C=C5)/C8=C(C(=C(C=C8C)C)S(=O)(=O)CCP(CC)CC)C)/C9=C(C(=C(C=C9C)C)S(=O)(=O)CCP(CC)CC)C)/C=C3)C)C)CC

InChI

InChI=1S/C80H108N4O8P4S4/c1-21-93(22-2)37-41-97(85,86)77-53(13)45-49(9)69(57(77)17)73-61-29-31-63(81-61)74(70-50(10)46-54(14)78(58(70)18)98(87,88)42-38-94(23-3)24-4)65-33-35-67(83-65)76(72-52(12)48-56(16)80(60(72)20)100(91,92)44-40-96(27-7)28-8)68-36-34-66(84-68)75(64-32-30-62(73)82-64)71-51(11)47-55(15)79(59(71)19)99(89,90)43-39-95(25-5)26-6/h29-36,45-48,81-84H,21-28,37-44H2,1-20H3/b73-61+,73-62?,74-63+,74-65?,75-64?,75-66+,76-67?,76-68+