2-[4-[(E)-3-(3-bromophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-(3-bromophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(3-bromophenyl)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(3-bromophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(3-bromophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(3-bromophenyl)-3-keto-prop-1-enyl]-2-methoxy-phenoxy]acetonitrile Formula: C18H14BrNO3 MolecularWeight: 372.21266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C2=CC(=CC=C2)Br)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)C2=CC(=CC=C2)Br)OCC#N

InChI

InChI=1S/C18H14BrNO3/c1-22-18-11-13(6-8-17(18)23-10-9-20)5-7-16(21)14-3-2-4-15(19)12-14/h2-8,11-12H,10H2,1H3/b7-5+