ethyl 4-[2-[(4-chlorophenyl)carbonyl-prop-2-enyl-amino]ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-[(4-chlorophenyl)carbonyl-prop-2-enyl-amino]ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[allyl-(4-chlorobenzoyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[(4-chlorophenyl)-oxomethyl]-prop-2-enylamino]-1-oxoethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-chlorobenzoyl)-prop-2-enylamino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[allyl-(4-chlorobenzoyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN(CC=C)C(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN(CC=C)C(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C21H23ClN2O4/c1-5-11-24(20(26)15-7-9-16(22)10-8-15)12-17(25)18-13(3)19(23-14(18)4)21(27)28-6-2/h5,7-10,23H,1,6,11-12H2,2-4H3