2-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 2-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 2-[2-(3,5-dimethylanilino)-2-oxo-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid CAS Name: 2-[2-(3,5-dimethylanilino)-2-oxoethyl]-1,4-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 2-[2-(3,5-dimethylanilino)-2-oxoethyl]-1,4-dimethylpyrrole-3-carboxylic acid Traditional Name: 2-[2-(3,5-dimethylanilino)-2-keto-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid Formula: C17H20N2O3 MolecularWeight: 300.3523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CC2=C(C(=CN2C)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CC2=C(C(=CN2C)C)C(=O)O)C

InChI

InChI=1S/C17H20N2O3/c1-10-5-11(2)7-13(6-10)18-15(20)8-14-16(17(21)22)12(3)9-19(14)4/h5-7,9H,8H2,1-4H3,(H,18,20)(H,21,22)