(E)-3-(4-hexoxy-3-methoxy-phenyl)-2-piperidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(4-hexoxy-3-methoxy-phenyl)-2-piperidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-hexoxy-3-methoxy-phenyl)-2-(piperidine-1-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(4-hexoxy-3-methoxyphenyl)-2-[oxo(1-piperidinyl)methyl]-2-propenenitrile IUPAC Name: (E)-3-(4-hexoxy-3-methoxyphenyl)-2-(piperidine-1-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(4-hexoxy-3-methoxy-phenyl)-2-(piperidine-1-carbonyl)acrylonitrile Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)N2CCCCC2)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)N2CCCCC2)OC

InChI

InChI=1S/C22H30N2O3/c1-3-4-5-9-14-27-20-11-10-18(16-21(20)26-2)15-19(17-23)22(25)24-12-7-6-8-13-24/h10-11,15-16H,3-9,12-14H2,1-2H3/b19-15+