N,N-dimethyl-4-[17,18,20-tris(4-dimethylaminophenyl)-21,22-dihydroporphyrin-2-yl]aniline

Systemtic Name: N,N-dimethyl-4-[17,18,20-tris(4-dimethylaminophenyl)-21,22-dihydroporphyrin-2-yl]aniline Openeye Name: N,N-dimethyl-4-[17,18,20-tris(4-dimethylaminophenyl)-21,22-dihydroporphyrin-2-yl]aniline CAS Name: N,N-dimethyl-4-[17,18,20-tris(4-dimethylaminophenyl)-21,22-dihydroporphyrin-2-yl]aniline IUPAC Name: N,N-dimethyl-4-[17,18,20-tris(4-dimethylaminophenyl)-21,22-dihydroporphyrin-2-yl]aniline Traditional Name: dimethyl-[4-[3,5,7-tris(4-dimethylaminophenyl)-22,23-dihydroporphin-2-yl]phenyl]amine Formula: C52H50N8 MolecularWeight: 787.007

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C3C(=C4C(=C(C(=N4)C=C5C=CC(=N5)C=C6C=CC(=CC(=C2)N3)N6)C7=CC=C(C=C7)N(C)C)C8=CC=C(C=C8)N(C)C)C9=CC=C(C=C9)N(C)C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C3C(=C4C(=C(C(=N4)C=C5C=CC(=N5)C=C6C=CC(=CC(=C2)N3)N6)C7=CC=C(C=C7)N(C)C)C8=CC=C(C=C8)N(C)C)C9=CC=C(C=C9)N(C)C

InChI

InChI=1S/C52H50N8/c1-57(2)42-21-9-33(10-22-42)46-31-41-30-39-18-17-37(53-39)29-38-19-20-40(54-38)32-47-48(34-11-23-43(24-12-34)58(3)4)49(35-13-25-44(26-14-35)59(5)6)52(56-47)50(51(46)55-41)36-15-27-45(28-16-36)60(7)8/h9-32,53,55H,1-8H3