4-(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)benzaldehyde

Systemtic Name: 4-(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)benzaldehyde Openeye Name: 4-(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)benzaldehyde CAS Name: 4-(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)benzaldehyde IUPAC Name: 4-(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)benzaldehyde Traditional Name: 4-(5,10,15,20-tetraphenyl-21,22-dihydroporphin-2-yl)benzaldehyde Formula: C51H34N4O MolecularWeight: 718.84186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC(=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=C(C=C9)C=O)C1=CC=CC=C1)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC(=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=C(C=C9)C=O)C1=CC=CC=C1)N3

InChI

InChI=1S/C51H34N4O/c56-32-33-21-23-34(24-22-33)39-31-46-49(37-17-9-3-10-18-37)44-28-27-42(53-44)47(35-13-5-1-6-14-35)40-25-26-41(52-40)48(36-15-7-2-8-16-36)43-29-30-45(54-43)50(51(39)55-46)38-19-11-4-12-20-38/h1-32,53,55H