(3-bromanyl-2-phenyl-1-benzothiophen-4-yl)methyl ethanoate

Systemtic Name: (3-bromanyl-2-phenyl-1-benzothiophen-4-yl)methyl ethanoate Openeye Name: (3-bromo-2-phenyl-benzothiophen-4-yl)methyl acetate CAS Name: acetic acid (3-bromo-2-phenyl-1-benzothiophen-4-yl)methyl ester IUPAC Name: (3-bromo-2-phenyl-1-benzothiophen-4-yl)methyl acetate Traditional Name: acetic acid (3-bromo-2-phenyl-benzothiophen-4-yl)methyl ester Formula: C17H13BrO2S MolecularWeight: 361.25292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C2C(=CC=C1)SC(=C2Br)C3=CC=CC=C3

Isomeric SMILES

CC(=O)OCC1=C2C(=CC=C1)SC(=C2Br)C3=CC=CC=C3

InChI

InChI=1S/C17H13BrO2S/c1-11(19)20-10-13-8-5-9-14-15(13)16(18)17(21-14)12-6-3-2-4-7-12/h2-9H,10H2,1H3