4-[(1-butyl-5-oxidanylidene-pyrrolidin-3-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(1-butyl-5-oxidanylidene-pyrrolidin-3-yl)carbonylamino]benzoic acid Openeye Name: 4-[(1-butyl-5-oxo-pyrrolidine-3-carbonyl)amino]benzoic acid CAS Name: 4-[[(1-butyl-5-oxo-3-pyrrolidinyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(1-butyl-5-oxopyrrolidine-3-carbonyl)amino]benzoic acid Traditional Name: 4-[(1-butyl-5-keto-pyrrolidine-3-carbonyl)amino]benzoic acid Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H20N2O4/c1-2-3-8-18-10-12(9-14(18)19)15(20)17-13-6-4-11(5-7-13)16(21)22/h4-7,12H,2-3,8-10H2,1H3,(H,17,20)(H,21,22)