2-chloranyl-3-[(3-oxidanylidene-3-propoxy-2-propoxycarbonyl-prop-1-enyl)amino]benzoic acid

Systemtic Name: 2-chloranyl-3-[(3-oxidanylidene-3-propoxy-2-propoxycarbonyl-prop-1-enyl)amino]benzoic acid Openeye Name: 2-chloro-3-[(3-oxo-3-propoxy-2-propoxycarbonyl-prop-1-enyl)amino]benzoic acid CAS Name: 2-chloro-3-[[3-oxo-2-[oxo(propoxy)methyl]-3-propoxyprop-1-enyl]amino]benzoic acid IUPAC Name: 2-chloro-3-[(3-oxo-3-propoxy-2-propoxycarbonylprop-1-enyl)amino]benzoic acid Traditional Name: 2-chloro-3-[(3-keto-3-propoxy-2-propoxycarbonyl-prop-1-enyl)amino]benzoic acid Formula: C17H20ClNO6 MolecularWeight: 369.7968

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(=CNC1=CC=CC(=C1Cl)C(=O)O)C(=O)OCCC

Isomeric SMILES

CCCOC(=O)C(=CNC1=CC=CC(=C1Cl)C(=O)O)C(=O)OCCC

InChI

InChI=1S/C17H20ClNO6/c1-3-8-24-16(22)12(17(23)25-9-4-2)10-19-13-7-5-6-11(14(13)18)15(20)21/h5-7,10,19H,3-4,8-9H2,1-2H3,(H,20,21)