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

Systemtic Name: 2-[2-methoxy-4-[(E)-3-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile Openeye Name: 2-[2-methoxy-4-[(E)-3-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]-3-oxo-prop-1-enyl]phenoxy]acetonitrile CAS Name: 2-[2-methoxy-4-[(E)-3-[4-(2-methyl-1-oxo-2-phenylpropyl)-1-piperazinyl]-3-oxoprop-1-enyl]phenoxy]acetonitrile IUPAC Name: 2-[2-methoxy-4-[(E)-3-[4-(2-methyl-2-phenylpropanoyl)piperazin-1-yl]-3-oxoprop-1-enyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-keto-3-[4-(2-methyl-2-phenyl-propanoyl)piperazino]prop-1-enyl]-2-methoxy-phenoxy]acetonitrile Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N3O4/c1-26(2,21-7-5-4-6-8-21)25(31)29-16-14-28(15-17-29)24(30)12-10-20-9-11-22(33-18-13-27)23(19-20)32-3/h4-12,19H,14-18H2,1-3H3/b12-10+