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

Systemtic Name: 2-[4-[(E)-3-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-[4-(2-ethoxyphenyl)-1-piperazinyl]-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-keto-3-(4-o-phenetylpiperazino)prop-1-enyl]-2-methoxy-phenoxy]acetonitrile Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C=CC3=CC(=C(C=C3)OCC#N)OC

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)/C=C/C3=CC(=C(C=C3)OCC#N)OC

InChI

InChI=1S/C24H27N3O4/c1-3-30-21-7-5-4-6-20(21)26-13-15-27(16-14-26)24(28)11-9-19-8-10-22(31-17-12-25)23(18-19)29-2/h4-11,18H,3,13-17H2,1-2H3/b11-9+