[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl] (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C16H13ClO4S MolecularWeight: 336.79002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC(=O)C=CC2=CC=CS2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC(=O)/C=C/C2=CC=CS2)Cl

InChI

InChI=1S/C16H13ClO4S/c1-20-15-6-4-11(9-13(15)17)14(18)10-21-16(19)7-5-12-3-2-8-22-12/h2-9H,10H2,1H3/b7-5+