ethyl 3,5-dimethyl-4-(1-phenylbutan-2-ylcarbamoyl)-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-(1-phenylbutan-2-ylcarbamoyl)-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-(1-benzylpropylcarbamoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[oxo-(1-phenylbutan-2-ylamino)methyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-(1-phenylbutan-2-ylcarbamoyl)-1H-pyrrole-2-carboxylate Traditional Name: 4-(1-benzylpropylcarbamoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)NC(=O)C2=C(NC(=C2C)C(=O)OCC)C

Isomeric SMILES

CCC(CC1=CC=CC=C1)NC(=O)C2=C(NC(=C2C)C(=O)OCC)C

InChI

InChI=1S/C20H26N2O3/c1-5-16(12-15-10-8-7-9-11-15)22-19(23)17-13(3)18(21-14(17)4)20(24)25-6-2/h7-11,16,21H,5-6,12H2,1-4H3,(H,22,23)