(Z)-3-(2-chloranyl-5-methoxy-4-oxidanyl-phenyl)-2-piperidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-(2-chloranyl-5-methoxy-4-oxidanyl-phenyl)-2-piperidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: (Z)-3-(2-chloro-4-hydroxy-5-methoxy-phenyl)-2-(piperidine-1-carbonyl)prop-2-enenitrile CAS Name: (Z)-3-(2-chloro-4-hydroxy-5-methoxyphenyl)-2-[oxo(1-piperidinyl)methyl]-2-propenenitrile IUPAC Name: (Z)-3-(2-chloro-4-hydroxy-5-methoxyphenyl)-2-(piperidine-1-carbonyl)prop-2-enenitrile Traditional Name: (Z)-3-(2-chloro-4-hydroxy-5-methoxy-phenyl)-2-(piperidine-1-carbonyl)acrylonitrile Formula: C16H17ClN2O3 MolecularWeight: 320.77078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)N2CCCCC2)Cl)O

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(/C#N)\C(=O)N2CCCCC2)Cl)O

InChI

InChI=1S/C16H17ClN2O3/c1-22-15-8-11(13(17)9-14(15)20)7-12(10-18)16(21)19-5-3-2-4-6-19/h7-9,20H,2-6H2,1H3/b12-7-