2-[[1-[4-chloranyl-2-(phenylcarbonyl)phenyl]-5-methyl-pyrrol-2-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[1-[4-chloranyl-2-(phenylcarbonyl)phenyl]-5-methyl-pyrrol-2-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[1-(2-benzoyl-4-chloro-phenyl)-5-methyl-pyrrol-2-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[1-(2-benzoyl-4-chlorophenyl)-5-methyl-2-pyrrolyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[1-(2-benzoyl-4-chlorophenyl)-5-methylpyrrol-2-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[1-(2-benzoyl-4-chloro-phenyl)-5-methyl-pyrrol-2-yl]methyl]isoindoline-1,3-quinone Formula: C27H19ClN2O3 MolecularWeight: 454.90436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC=C(N1C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H19ClN2O3/c1-17-11-13-20(16-29-26(32)21-9-5-6-10-22(21)27(29)33)30(17)24-14-12-19(28)15-23(24)25(31)18-7-3-2-4-8-18/h2-15H,16H2,1H3