3,3-dimethyl-15-pentyl-20-phenyl-22,23-dihydro-2H-porphyrin

Systemtic Name: 3,3-dimethyl-15-pentyl-20-phenyl-22,23-dihydro-2H-porphyrin Openeye Name: 3,3-dimethyl-15-pentyl-20-phenyl-22,23-dihydro-2H-porphyrin CAS Name: 3,3-dimethyl-15-pentyl-20-phenyl-22,23-dihydro-2H-porphyrin IUPAC Name: 3,3-dimethyl-15-pentyl-20-phenyl-22,23-dihydro-2H-porphyrin Traditional Name: 15-amyl-3,3-dimethyl-20-phenyl-22,23-dihydro-2H-porphine Formula: C33H34N4 MolecularWeight: 486.64986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C2C=CC(=N2)C(=C3CC(C(=N3)C=C4C=CC(=CC5=CC=C1N5)N4)(C)C)C6=CC=CC=C6

Isomeric SMILES

CCCCCC1=C2C=CC(=N2)C(=C3CC(C(=N3)C=C4C=CC(=CC5=CC=C1N5)N4)(C)C)C6=CC=CC=C6

InChI

InChI=1S/C33H34N4/c1-4-5-7-12-26-27-16-15-24(35-27)19-23-13-14-25(34-23)20-31-33(2,3)21-30(37-31)32(22-10-8-6-9-11-22)29-18-17-28(26)36-29/h6,8-11,13-20,34-35H,4-5,7,12,21H2,1-3H3