(Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-oxidanylpiperidin-1-yl)thiophen-2-yl]prop-2-enenitrile

Systemtic Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-oxidanylpiperidin-1-yl)thiophen-2-yl]prop-2-enenitrile Openeye Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-hydroxy-1-piperidyl)-2-thienyl]prop-2-enenitrile CAS Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-hydroxy-1-piperidinyl)-2-thiophenyl]-2-propenenitrile IUPAC Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-hydroxypiperidin-1-yl)thiophen-2-yl]prop-2-enenitrile Traditional Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-hydroxypiperidino)-2-thienyl]acrylonitrile Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC#N)C2=CC=C(S2)N3CCC(CC3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C/C#N)/C2=CC=C(S2)N3CCC(CC3)O)OC

InChI

InChI=1S/C20H22N2O3S/c1-24-17-4-3-14(13-18(17)25-2)16(7-10-21)19-5-6-20(26-19)22-11-8-15(23)9-12-22/h3-7,13,15,23H,8-9,11-12H2,1-2H3/b16-7-