2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-10,20-diphenyl-21,22-dihydroporphyrin

Systemtic Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-10,20-diphenyl-21,22-dihydroporphyrin Openeye Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-10,20-diphenyl-21,22-dihydroporphyrin CAS Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-10,20-diphenyl-21,22-dihydroporphyrin IUPAC Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-10,20-diphenyl-21,22-dihydroporphyrin Traditional Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-10,20-diphenyl-21,22-dihydroporphine Formula: C52H62N4 MolecularWeight: 743.07548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC3=C(C(=C(N3)C(=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C(=C1N2)C6=CC=CC=C6)CCCC)C)C)CCCC)C7=CC=CC=C7)CCCC)C)C

Isomeric SMILES

CCCCC1=C(C2=CC3=C(C(=C(N3)C(=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C(=C1N2)C6=CC=CC=C6)CCCC)C)C)CCCC)C7=CC=CC=C7)CCCC)C)C

InChI

InChI=1S/C52H62N4/c1-9-13-27-39-33(5)43-31-44-35(7)41(29-15-11-3)51(55-44)48(38-25-21-18-22-26-38)52-42(30-16-12-4)36(8)46(56-52)32-45-34(6)40(28-14-10-2)50(54-45)47(49(39)53-43)37-23-19-17-20-24-37/h17-26,31-32,53,55H,9-16,27-30H2,1-8H3