5,15-dipentyl-10,20-diphenyl-21,22-dihydroporphyrin

Systemtic Name: 5,15-dipentyl-10,20-diphenyl-21,22-dihydroporphyrin Openeye Name: 5,15-dipentyl-10,20-diphenyl-21,22-dihydroporphyrin CAS Name: 5,15-dipentyl-10,20-diphenyl-21,22-dihydroporphyrin IUPAC Name: 5,15-dipentyl-10,20-diphenyl-21,22-dihydroporphyrin Traditional Name: 5,15-diamyl-10,20-diphenyl-21,22-dihydroporphine Formula: C42H42N4 MolecularWeight: 602.80968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C2C=CC(=C(C3=NC(=C(C4=NC(=C(C5=CC=C1N5)C6=CC=CC=C6)C=C4)CCCCC)C=C3)C7=CC=CC=C7)N2

Isomeric SMILES

CCCCCC1=C2C=CC(=C(C3=NC(=C(C4=NC(=C(C5=CC=C1N5)C6=CC=CC=C6)C=C4)CCCCC)C=C3)C7=CC=CC=C7)N2

InChI

InChI=1S/C42H42N4/c1-3-5-9-19-31-33-21-25-37(43-33)41(29-15-11-7-12-16-29)39-27-23-35(45-39)32(20-10-6-4-2)36-24-28-40(46-36)42(30-17-13-8-14-18-30)38-26-22-34(31)44-38/h7-8,11-18,21-28,43-44H,3-6,9-10,19-20H2,1-2H3