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

Systemtic Name: 4-[(9Z,15Z,19Z)-15-phenyl-23,24-dihydro-21H-porphyrin-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(9Z,15Z,19Z)-15-phenyl-23,24-dihydro-21H-porphyrin-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[(9Z,15Z,19Z)-15-phenyl-23,24-dihydro-21H-porphyrin-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(9Z,15Z,19Z)-15-phenyl-23,24-dihydro-21H-porphyrin-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[(9Z,15Z,19Z)-15-phenyl-23,24-dihydro-21H-porphin-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C32H22N4O MolecularWeight: 478.54328

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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(=O)C=C5)C6=NC(=CC7=CC=C2N7)C=C6)N3

Isomeric SMILES

C1=CC=C(C=C1)/C/2=C/3\C=C/C(=C/C4=CC=C(N4)C(=C5C=CC(=O)C=C5)C6=N/C(=C\C7=CC=C2N7)/C=C6)/N3

InChI

InChI=1S/C32H22N4O/c37-26-12-6-21(7-13-26)32-29-16-10-24(35-29)18-22-8-14-27(33-22)31(20-4-2-1-3-5-20)28-15-9-23(34-28)19-25-11-17-30(32)36-25/h1-19,33-35H/b22-18-,25-19-,31-27-