dimethyl 3-[(4-chloranyl-2-methyl-phenyl)carbamoyl]pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate

Systemtic Name: dimethyl 3-[(4-chloranyl-2-methyl-phenyl)carbamoyl]pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate Openeye Name: dimethyl 3-[(4-chloro-2-methyl-phenyl)carbamoyl]pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate CAS Name: 3-[(4-chloro-2-methylanilino)-oxomethyl]pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-[(4-chloro-2-methylphenyl)carbamoyl]pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate Traditional Name: 3-[(4-chloro-2-methyl-phenyl)carbamoyl]pyrrol[2,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester Formula: C24H19ClN2O5 MolecularWeight: 450.87106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)C2=C(C(=C3N2C=CC4=CC=CC=C43)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)C2=C(C(=C3N2C=CC4=CC=CC=C43)C(=O)OC)C(=O)OC

InChI

InChI=1S/C24H19ClN2O5/c1-13-12-15(25)8-9-17(13)26-22(28)21-19(24(30)32-3)18(23(29)31-2)20-16-7-5-4-6-14(16)10-11-27(20)21/h4-12H,1-3H3,(H,26,28)