[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] (E)-3-(3-bromophenyl)prop-2-enoate

Systemtic Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] (E)-3-(3-bromophenyl)prop-2-enoate Openeye Name: [2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl] (E)-3-(3-bromophenyl)prop-2-enoate CAS Name: (E)-3-(3-bromophenyl)-2-propenoic acid [2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl] (E)-3-(3-bromophenyl)prop-2-enoate Traditional Name: (E)-3-(3-bromophenyl)acrylic acid [2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl] ester Formula: C17H15BrO3S MolecularWeight: 379.2682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)COC(=O)C=CC2=CC(=CC=C2)Br

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)COC(=O)/C=C/C2=CC(=CC=C2)Br

InChI

InChI=1S/C17H15BrO3S/c1-11-8-15(12(2)22-11)16(19)10-21-17(20)7-6-13-4-3-5-14(18)9-13/h3-9H,10H2,1-2H3/b7-6+