7,7-dimethyl-N2,N12-diphenyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxamide

Systemtic Name: 7,7-dimethyl-N2,N12-diphenyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxamide Openeye Name: 7,7-dimethyl-N2,N12-diphenyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxamide CAS Name: 7,7-dimethyl-N2,N12-diphenyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxamide IUPAC Name: 7,7-dimethyl-2-N,12-N-diphenyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxamide Traditional Name: 15-mesityl-7,7-dimethyl-N,N'-diphenyl-21,24-dihydro-8H-porphine-2,12-dicarboxamide Formula: C45H40N6O2 MolecularWeight: 696.8381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=CC4=C(C=C(N4)C=C5C(CC(=N5)C=C6C(=CC2=N6)C(=O)NC7=CC=CC=C7)(C)C)C(=O)NC8=CC=CC=C8)N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=CC4=C(C=C(N4)C=C5C(CC(=N5)C=C6C(=CC2=N6)C(=O)NC7=CC=CC=C7)(C)C)C(=O)NC8=CC=CC=C8)N3)C

InChI

InChI=1S/C45H40N6O2/c1-26-18-27(2)41(28(3)19-26)42-36-17-16-31(46-36)21-37-34(43(52)49-29-12-8-6-9-13-29)20-32(47-37)23-40-45(4,5)25-33(48-40)22-38-35(24-39(42)51-38)44(53)50-30-14-10-7-11-15-30/h6-24,46-47H,25H2,1-5H3,(H,49,52)(H,50,53)