5-(4-chlorophenyl)carbonyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-1,4-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 5-(4-chlorophenyl)carbonyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-1,4-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 5-(4-chlorobenzoyl)-2-(2-ethoxy-2-oxo-ethyl)-1,4-dimethyl-pyrrole-3-carboxylic acid CAS Name: 5-[(4-chlorophenyl)-oxomethyl]-2-(2-ethoxy-2-oxoethyl)-1,4-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 5-(4-chlorobenzoyl)-2-(2-ethoxy-2-oxoethyl)-1,4-dimethylpyrrole-3-carboxylic acid Traditional Name: 5-(4-chlorobenzoyl)-2-(2-ethoxy-2-keto-ethyl)-1,4-dimethyl-pyrrole-3-carboxylic acid Formula: C18H18ClNO5 MolecularWeight: 363.79222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=C(N1C)C(=O)C2=CC=C(C=C2)Cl)C)C(=O)O

Isomeric SMILES

CCOC(=O)CC1=C(C(=C(N1C)C(=O)C2=CC=C(C=C2)Cl)C)C(=O)O

InChI

InChI=1S/C18H18ClNO5/c1-4-25-14(21)9-13-15(18(23)24)10(2)16(20(13)3)17(22)11-5-7-12(19)8-6-11/h5-8H,4,9H2,1-3H3,(H,23,24)