4-(2-oxidanylidenepyrrolidin-1-yl)-3-(pentan-3-ylamino)benzoic acid

Systemtic Name: 4-(2-oxidanylidenepyrrolidin-1-yl)-3-(pentan-3-ylamino)benzoic acid Openeye Name: 3-(1-ethylpropylamino)-4-(2-oxopyrrolidin-1-yl)benzoic acid CAS Name: 4-(2-oxo-1-pyrrolidinyl)-3-(pentan-3-ylamino)benzoic acid IUPAC Name: 4-(2-oxopyrrolidin-1-yl)-3-(pentan-3-ylamino)benzoic acid Traditional Name: 3-(1-ethylpropylamino)-4-(2-ketopyrrolidino)benzoic acid Formula: C16H22N2O3 MolecularWeight: 290.35748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=CC(=C1)C(=O)O)N2CCCC2=O

Isomeric SMILES

CCC(CC)NC1=C(C=CC(=C1)C(=O)O)N2CCCC2=O

InChI

InChI=1S/C16H22N2O3/c1-3-12(4-2)17-13-10-11(16(20)21)7-8-14(13)18-9-5-6-15(18)19/h7-8,10,12,17H,3-6,9H2,1-2H3,(H,20,21)