methyl 3-[7,13-diethyl-18-(3-methoxy-3-oxidanylidene-propyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphyrin-2-yl]propanoate

Systemtic Name: methyl 3-[7,13-diethyl-18-(3-methoxy-3-oxidanylidene-propyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphyrin-2-yl]propanoate Openeye Name: methyl 3-[7,13-diethyl-18-(3-methoxy-3-oxo-propyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphyrin-2-yl]propanoate CAS Name: 3-[7,13-diethyl-18-(3-methoxy-3-oxopropyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphyrin-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[7,13-diethyl-18-(3-methoxy-3-oxopropyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphyrin-2-yl]propanoate Traditional Name: 3-[7,13-diethyl-18-(3-keto-3-methoxy-propyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphin-2-yl]propionic acid methyl ester Formula: C43H48N4O5 MolecularWeight: 700.86502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=CC1=N2)N5)C)CCC(=O)OC)CCC(=O)OC)C)C(=C3C)CC)C6=CC=C(C=C6)OC)C

Isomeric SMILES

CCC1=C(C2=C(C3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=CC1=N2)N5)C)CCC(=O)OC)CCC(=O)OC)C)C(=C3C)CC)C6=CC=C(C=C6)OC)C

InChI

InChI=1S/C43H48N4O5/c1-10-29-25(5)42-41(27-12-14-28(50-7)15-13-27)43-26(6)30(11-2)36(47-43)21-34-24(4)32(17-19-40(49)52-9)38(45-34)22-37-31(16-18-39(48)51-8)23(3)33(44-37)20-35(29)46-42/h12-15,20-22,44-45H,10-11,16-19H2,1-9H3