3-(1-butyl-2-oxidanylidene-quinolin-4-yl)-2-[(4-chlorophenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(1-butyl-2-oxidanylidene-quinolin-4-yl)-2-[(4-chlorophenyl)carbonylamino]propanoic acid Openeye Name: 3-(1-butyl-2-oxo-4-quinolyl)-2-[(4-chlorobenzoyl)amino]propanoic acid CAS Name: 3-(1-butyl-2-oxo-4-quinolinyl)-2-[[(4-chlorophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(1-butyl-2-oxoquinolin-4-yl)-2-[(4-chlorobenzoyl)amino]propanoic acid Traditional Name: 3-(1-butyl-2-keto-4-quinolyl)-2-[(4-chlorobenzoyl)amino]propionic acid Formula: C23H23ClN2O4 MolecularWeight: 426.89272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=CC1=O)CC(C(=O)O)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=CC1=O)CC(C(=O)O)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H23ClN2O4/c1-2-3-12-26-20-7-5-4-6-18(20)16(14-21(26)27)13-19(23(29)30)25-22(28)15-8-10-17(24)11-9-15/h4-11,14,19H,2-3,12-13H2,1H3,(H,25,28)(H,29,30)