ethyl 4-ethyl-2-[[(4-methoxyphenyl)amino]methyl]-5-(propan-2-ylcarbamoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-ethyl-2-[[(4-methoxyphenyl)amino]methyl]-5-(propan-2-ylcarbamoyl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-ethyl-5-(isopropylcarbamoyl)-2-[(4-methoxyanilino)methyl]-1H-pyrrole-3-carboxylate CAS Name: 4-ethyl-2-[(4-methoxyanilino)methyl]-5-[oxo-(propan-2-ylamino)methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-[(4-methoxyanilino)methyl]-5-(propan-2-ylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 4-ethyl-5-(isopropylcarbamoyl)-2-(p-anisidinomethyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)OCC)CNC2=CC=C(C=C2)OC)C(=O)NC(C)C

Isomeric SMILES

CCC1=C(NC(=C1C(=O)OCC)CNC2=CC=C(C=C2)OC)C(=O)NC(C)C

InChI

InChI=1S/C21H29N3O4/c1-6-16-18(21(26)28-7-2)17(24-19(16)20(25)23-13(3)4)12-22-14-8-10-15(27-5)11-9-14/h8-11,13,22,24H,6-7,12H2,1-5H3,(H,23,25)