2-[[(2-acetyloxy-5-methyl-phenyl)-(4-chlorophenyl)methylidene]amino]propanedioic acid

Systemtic Name: 2-[[(2-acetyloxy-5-methyl-phenyl)-(4-chlorophenyl)methylidene]amino]propanedioic acid Openeye Name: 2-[[(2-acetoxy-5-methyl-phenyl)-(4-chlorophenyl)methylene]amino]propanedioic acid CAS Name: 2-[[(2-acetyloxy-5-methylphenyl)-(4-chlorophenyl)methylidene]amino]propanedioic acid IUPAC Name: 2-[[(2-acetyloxy-5-methylphenyl)-(4-chlorophenyl)methylidene]amino]propanedioic acid Traditional Name: 2-[[(2-acetoxy-5-methyl-phenyl)-(4-chlorophenyl)methylene]amino]malonic acid Formula: C19H16ClNO6 MolecularWeight: 389.78644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C)C(=NC(C(=O)O)C(=O)O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C)C(=NC(C(=O)O)C(=O)O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H16ClNO6/c1-10-3-8-15(27-11(2)22)14(9-10)16(12-4-6-13(20)7-5-12)21-17(18(23)24)19(25)26/h3-9,17H,1-2H3,(H,23,24)(H,25,26)