5,10,15,20-tetraphenyl-2-(1H-pyrrol-2-yl)-21,22-dihydroporphyrin

Systemtic Name: 5,10,15,20-tetraphenyl-2-(1H-pyrrol-2-yl)-21,22-dihydroporphyrin Openeye Name: 5,10,15,20-tetraphenyl-2-(1H-pyrrol-2-yl)-21,22-dihydroporphyrin CAS Name: 5,10,15,20-tetraphenyl-2-(1H-pyrrol-2-yl)-21,22-dihydroporphyrin IUPAC Name: 5,10,15,20-tetraphenyl-2-(1H-pyrrol-2-yl)-21,22-dihydroporphyrin Traditional Name: 5,10,15,20-tetraphenyl-2-(1H-pyrrol-2-yl)-21,22-dihydroporphine Formula: C48H33N5 MolecularWeight: 679.80912

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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=CN9)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=CN9)C1=CC=CC=C1)N3

InChI

InChI=1S/C48H33N5/c1-5-14-31(15-6-1)44-37-23-24-38(50-37)45(32-16-7-2-8-17-32)40-27-28-42(52-40)47(34-20-11-4-12-21-34)48-35(36-22-13-29-49-36)30-43(53-48)46(33-18-9-3-10-19-33)41-26-25-39(44)51-41/h1-30,49,51,53H