20-bromanyl-17,17-dimethyl-N-phenyl-5-(2,4,6-trimethylphenyl)-22,23-dihydro-18H-porphyrin-2-carboxamide

Systemtic Name: 20-bromanyl-17,17-dimethyl-N-phenyl-5-(2,4,6-trimethylphenyl)-22,23-dihydro-18H-porphyrin-2-carboxamide Openeye Name: 20-bromo-17,17-dimethyl-N-phenyl-5-(2,4,6-trimethylphenyl)-22,23-dihydro-18H-porphyrin-2-carboxamide CAS Name: 20-bromo-17,17-dimethyl-N-phenyl-5-(2,4,6-trimethylphenyl)-22,23-dihydro-18H-porphyrin-2-carboxamide IUPAC Name: 20-bromo-17,17-dimethyl-N-phenyl-5-(2,4,6-trimethylphenyl)-22,23-dihydro-18H-porphyrin-2-carboxamide Traditional Name: 20-bromo-5-mesityl-17,17-dimethyl-N-phenyl-22,23-dihydro-18H-porphine-2-carboxamide Formula: C38H34BrN5O MolecularWeight: 656.61346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C3C=C(C(=N3)C(=C4CC(C(=N4)C=C5C=CC(=CC6=CC=C2N6)N5)(C)C)Br)C(=O)NC7=CC=CC=C7)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C3C=C(C(=N3)C(=C4CC(C(=N4)C=C5C=CC(=CC6=CC=C2N6)N5)(C)C)Br)C(=O)NC7=CC=CC=C7)C

InChI

InChI=1S/C38H34BrN5O/c1-21-15-22(2)33(23(3)16-21)34-29-14-13-26(41-29)17-25-11-12-27(40-25)18-32-38(4,5)20-31(43-32)35(39)36-28(19-30(34)44-36)37(45)42-24-9-7-6-8-10-24/h6-19,40-41H,20H2,1-5H3,(H,42,45)