methyl 4-(diethylcarbamoyl)-2,5-dimethyl-1-[(3-methylphenyl)carbonylamino]pyrrole-3-carboxylate

Systemtic Name: methyl 4-(diethylcarbamoyl)-2,5-dimethyl-1-[(3-methylphenyl)carbonylamino]pyrrole-3-carboxylate Openeye Name: methyl 4-(diethylcarbamoyl)-2,5-dimethyl-1-[(3-methylbenzoyl)amino]pyrrole-3-carboxylate CAS Name: 4-[diethylamino(oxo)methyl]-2,5-dimethyl-1-[[(3-methylphenyl)-oxomethyl]amino]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(diethylcarbamoyl)-2,5-dimethyl-1-[(3-methylbenzoyl)amino]pyrrole-3-carboxylate Traditional Name: 4-(diethylcarbamoyl)-2,5-dimethyl-1-(m-toluoylamino)pyrrole-3-carboxylic acid methyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(N(C(=C1C(=O)OC)C)NC(=O)C2=CC(=CC=C2)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(N(C(=C1C(=O)OC)C)NC(=O)C2=CC(=CC=C2)C)C

InChI

InChI=1S/C21H27N3O4/c1-7-23(8-2)20(26)17-14(4)24(15(5)18(17)21(27)28-6)22-19(25)16-11-9-10-13(3)12-16/h9-12H,7-8H2,1-6H3,(H,22,25)