(Z)-2-(3,4-dimethoxyphenyl)-3-(5-piperidin-1-ylthiophen-2-yl)prop-2-enenitrile hydrochloride

Systemtic Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(5-piperidin-1-ylthiophen-2-yl)prop-2-enenitrile hydrochloride Openeye Name: (Z)-2-(3,4-dimethoxyphenyl)-3-[5-(1-piperidyl)-2-thienyl]prop-2-enenitrile hydrochloride CAS Name: (Z)-2-(3,4-dimethoxyphenyl)-3-[5-(1-piperidinyl)-2-thiophenyl]-2-propenenitrile hydrochloride IUPAC Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(5-piperidin-1-ylthiophen-2-yl)prop-2-enenitrile hydrochloride Traditional Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(5-piperidino-2-thienyl)acrylonitrile hydrochloride Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC2=CC=C(S2)N3CCCCC3)C#N)OC.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C/C2=CC=C(S2)N3CCCCC3)/C#N)OC.Cl

InChI

InChI=1S/C20H22N2O2S.ClH/c1-23-18-8-6-15(13-19(18)24-2)16(14-21)12-17-7-9-20(25-17)22-10-4-3-5-11-22;/h6-9,12-13H,3-5,10-11H2,1-2H3;1H/b16-12+;