[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 2-methylbenzoate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 2-methylbenzoate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-2-oxo-ethyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [2-(3-bromo-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C17H15BrO4 MolecularWeight: 363.2026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OCC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)OCC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C17H15BrO4/c1-11-5-3-4-6-13(11)17(20)22-10-15(19)12-7-8-16(21-2)14(18)9-12/h3-9H,10H2,1-2H3