1-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[3-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[oxo-[3-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[3-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[3-[(2-ketopyrrolidino)methyl]benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C22H22N2O4 MolecularWeight: 378.42108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2N(C1)C(=O)C3=CC(=CC=C3)CN4CCCC4=O)C(=O)O

Isomeric SMILES

C1CC2=C(C=CC=C2N(C1)C(=O)C3=CC(=CC=C3)CN4CCCC4=O)C(=O)O

InChI

InChI=1S/C22H22N2O4/c25-20-10-4-11-23(20)14-15-5-1-6-16(13-15)21(26)24-12-3-8-17-18(22(27)28)7-2-9-19(17)24/h1-2,5-7,9,13H,3-4,8,10-12,14H2,(H,27,28)