2-[4-[(E)-3-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-oxo-prop-1-enyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-3-oxoprop-1-enyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-oxoprop-1-enyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-keto-3-(4-p-anisoylpiperazino)prop-1-enyl]phenoxy]acetonitrile Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C=CC3=CC=C(C=C3)OCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)/C=C/C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C23H23N3O4/c1-29-20-9-5-19(6-10-20)23(28)26-15-13-25(14-16-26)22(27)11-4-18-2-7-21(8-3-18)30-17-12-24/h2-11H,13-17H2,1H3/b11-4+