(E)-3-(2,3-dimethoxyphenyl)-1-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(2,3-dimethoxyphenyl)-1-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(2,3-dimethoxyphenyl)-1-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(2,3-dimethoxyphenyl)-1-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(2,3-dimethoxyphenyl)-1-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(2,3-dimethoxyphenyl)-1-[4-(2-keto-2-piperidino-ethyl)piperazino]prop-2-en-1-one Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=CC(=O)N2CCN(CC2)CC(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=C/C(=O)N2CCN(CC2)CC(=O)N3CCCCC3

InChI

InChI=1S/C22H31N3O4/c1-28-19-8-6-7-18(22(19)29-2)9-10-20(26)25-15-13-23(14-16-25)17-21(27)24-11-4-3-5-12-24/h6-10H,3-5,11-17H2,1-2H3/b10-9+