ethyl 3,5-dimethyl-4-(2-morpholin-4-ylethylcarbamoyl)-1-(phenylmethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-(2-morpholin-4-ylethylcarbamoyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-3,5-dimethyl-4-(2-morpholinoethylcarbamoyl)pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[[2-(4-morpholinyl)ethylamino]-oxomethyl]-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-3,5-dimethyl-4-(2-morpholin-4-ylethylcarbamoyl)pyrrole-2-carboxylate Traditional Name: 1-benzyl-3,5-dimethyl-4-(2-morpholinoethylcarbamoyl)pyrrole-2-carboxylic acid ethyl ester Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)NCCN3CCOCC3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)NCCN3CCOCC3)C

InChI

InChI=1S/C23H31N3O4/c1-4-30-23(28)21-17(2)20(18(3)26(21)16-19-8-6-5-7-9-19)22(27)24-10-11-25-12-14-29-15-13-25/h5-9H,4,10-16H2,1-3H3,(H,24,27)