2-chloranyl-3-[(3-oxidanylidene-3-propan-2-yloxy-2-propan-2-yloxycarbonyl-prop-1-enyl)amino]benzoic acid

Systemtic Name: 2-chloranyl-3-[(3-oxidanylidene-3-propan-2-yloxy-2-propan-2-yloxycarbonyl-prop-1-enyl)amino]benzoic acid Openeye Name: 2-chloro-3-[(3-isopropoxy-2-isopropoxycarbonyl-3-oxo-prop-1-enyl)amino]benzoic acid CAS Name: 2-chloro-3-[[3-oxo-2-[oxo(propan-2-yloxy)methyl]-3-propan-2-yloxyprop-1-enyl]amino]benzoic acid IUPAC Name: 2-chloro-3-[(3-oxo-3-propan-2-yloxy-2-propan-2-yloxycarbonylprop-1-enyl)amino]benzoic acid Traditional Name: 2-chloro-3-[(3-isopropoxy-2-isopropoxycarbonyl-3-keto-prop-1-enyl)amino]benzoic acid Formula: C17H20ClNO6 MolecularWeight: 369.7968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=CNC1=CC=CC(=C1Cl)C(=O)O)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)C(=CNC1=CC=CC(=C1Cl)C(=O)O)C(=O)OC(C)C

InChI

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