(E)-1-(2-pyridin-3-ylpiperidin-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(2-pyridin-3-ylpiperidin-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-[2-(3-pyridyl)-1-piperidyl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-[2-(3-pyridinyl)-1-piperidinyl]-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(2-pyridin-3-ylpiperidin-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[2-(3-pyridyl)piperidino]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCCCC2C3=CN=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)N2CCCCC2C3=CN=CC=C3

InChI

InChI=1S/C22H26N2O4/c1-26-19-13-16(14-20(27-2)22(19)28-3)9-10-21(25)24-12-5-4-8-18(24)17-7-6-11-23-15-17/h6-7,9-11,13-15,18H,4-5,8,12H2,1-3H3/b10-9+