ethyl 4-[(4-butoxycarbonylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(4-butoxycarbonylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(4-butoxycarbonylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[[4-[butoxy(oxo)methyl]anilino]-oxomethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-butoxycarbonylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(4-butoxycarbonylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(NC(=C2C)C(=O)OCC)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(NC(=C2C)C(=O)OCC)C

InChI

InChI=1S/C21H26N2O5/c1-5-7-12-28-20(25)15-8-10-16(11-9-15)23-19(24)17-13(3)18(22-14(17)4)21(26)27-6-2/h8-11,22H,5-7,12H2,1-4H3,(H,23,24)