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

Systemtic Name: 2-[2-methoxy-4-[(E)-3-[4-(3-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile Openeye Name: 2-[2-methoxy-4-[(E)-3-[4-(3-methoxyphenyl)piperazin-1-yl]-3-oxo-prop-1-enyl]phenoxy]acetonitrile CAS Name: 2-[2-methoxy-4-[(E)-3-[4-(3-methoxyphenyl)-1-piperazinyl]-3-oxoprop-1-enyl]phenoxy]acetonitrile IUPAC Name: 2-[2-methoxy-4-[(E)-3-[4-(3-methoxyphenyl)piperazin-1-yl]-3-oxoprop-1-enyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-keto-3-[4-(3-methoxyphenyl)piperazino]prop-1-enyl]-2-methoxy-phenoxy]acetonitrile Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O4/c1-28-20-5-3-4-19(17-20)25-11-13-26(14-12-25)23(27)9-7-18-6-8-21(30-15-10-24)22(16-18)29-2/h3-9,16-17H,11-15H2,1-2H3/b9-7+