(E)-2-chloranyl-3-[2-[(E)-N-methoxy-C-methoxycarbonyl-carbonimidoyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-2-chloranyl-3-[2-[(E)-N-methoxy-C-methoxycarbonyl-carbonimidoyl]phenyl]prop-2-enoic acid Openeye Name: (E)-2-chloro-3-[2-[(E)-N-methoxy-C-methoxycarbonyl-carbonimidoyl]phenyl]prop-2-enoic acid CAS Name: (E)-2-chloro-3-[2-[(1E)-2-methoxy-1-methoxyimino-2-oxoethyl]phenyl]-2-propenoic acid IUPAC Name: (E)-2-chloro-3-[2-[(E)-N-methoxy-C-methoxycarbonylcarbonimidoyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-[(E)-C-carbomethoxy-N-methoxy-carbonimidoyl]phenyl]-2-chloro-acrylic acid Formula: C13H12ClNO5 MolecularWeight: 297.69108

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=NOC)C1=CC=CC=C1C=C(C(=O)O)Cl

Isomeric SMILES

COC(=O)/C(=N/OC)/C1=CC=CC=C1/C=C(\C(=O)O)/Cl

InChI

InChI=1S/C13H12ClNO5/c1-19-13(18)11(15-20-2)9-6-4-3-5-8(9)7-10(14)12(16)17/h3-7H,1-2H3,(H,16,17)/b10-7+,15-11+