4-[(9Z,15Z,19Z)-10,20-diphenyl-23,24-dihydro-21H-porphyrin-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[(9Z,15Z,19Z)-10,20-diphenyl-23,24-dihydro-21H-porphyrin-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(9Z,15Z,19Z)-10,20-diphenyl-23,24-dihydro-21H-porphyrin-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[(9Z,15Z,19Z)-10,20-diphenyl-23,24-dihydro-21H-porphyrin-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(9Z,15Z,19Z)-10,20-diphenyl-23,24-dihydro-21H-porphyrin-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[(9Z,15Z,19Z)-10,20-diphenyl-23,24-dihydro-21H-porphin-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C38H26N4O MolecularWeight: 554.63924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC(=O)C=C6)C7=CC=C2N7)C8=CC=CC=C8)N3

Isomeric SMILES

C1=CC=C(C=C1)/C/2=C/3\C=C/C(=C/C4=CC=C(N4)/C(=C\5/C=CC(=N5)C(=C6C=CC(=O)C=C6)C7=CC=C2N7)/C8=CC=CC=C8)/N3

InChI

InChI=1S/C38H26N4O/c43-29-15-11-26(12-16-29)38-34-21-19-32(41-34)36(24-7-3-1-4-8-24)30-17-13-27(39-30)23-28-14-18-31(40-28)37(25-9-5-2-6-10-25)33-20-22-35(38)42-33/h1-23,39-41H/b27-23-,36-30-,37-33-