2-[(E)-3-(4-chloranyl-2H-chromen-3-yl)-2-methyl-prop-2-enylidene]propanedioic acid

Systemtic Name: 2-[(E)-3-(4-chloranyl-2H-chromen-3-yl)-2-methyl-prop-2-enylidene]propanedioic acid Openeye Name: 2-[(E)-3-(4-chloro-2H-chromen-3-yl)-2-methyl-prop-2-enylidene]propanedioic acid CAS Name: 2-[(E)-3-(4-chloro-2H-1-benzopyran-3-yl)-2-methylprop-2-enylidene]propanedioic acid IUPAC Name: 2-[(E)-3-(4-chloro-2H-chromen-3-yl)-2-methylprop-2-enylidene]propanedioic acid Traditional Name: 2-[(E)-3-(4-chloro-2H-chromen-3-yl)-2-methyl-prop-2-enylidene]malonic acid Formula: C16H13ClO5 MolecularWeight: 320.72442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=C(C2=CC=CC=C2OC1)Cl)C=C(C(=O)O)C(=O)O

Isomeric SMILES

C/C(=C\C1=C(C2=CC=CC=C2OC1)Cl)/C=C(C(=O)O)C(=O)O

InChI

InChI=1S/C16H13ClO5/c1-9(7-12(15(18)19)16(20)21)6-10-8-22-13-5-3-2-4-11(13)14(10)17/h2-7H,8H2,1H3,(H,18,19)(H,20,21)/b9-6+