(Z)-3-(3-iodanyl-4-oxidanyl-phenyl)-2-(4-methylpiperidin-1-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-(3-iodanyl-4-oxidanyl-phenyl)-2-(4-methylpiperidin-1-yl)carbonyl-prop-2-enenitrile Openeye Name: (Z)-3-(4-hydroxy-3-iodo-phenyl)-2-(4-methylpiperidine-1-carbonyl)prop-2-enenitrile CAS Name: (Z)-3-(4-hydroxy-3-iodophenyl)-2-[(4-methyl-1-piperidinyl)-oxomethyl]-2-propenenitrile IUPAC Name: (Z)-3-(4-hydroxy-3-iodophenyl)-2-(4-methylpiperidine-1-carbonyl)prop-2-enenitrile Traditional Name: (Z)-3-(4-hydroxy-3-iodo-phenyl)-2-(4-methylpiperidine-1-carbonyl)acrylonitrile Formula: C16H17IN2O2 MolecularWeight: 396.22285

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(=CC2=CC(=C(C=C2)O)I)C#N

Isomeric SMILES

CC1CCN(CC1)C(=O)/C(=C\C2=CC(=C(C=C2)O)I)/C#N

InChI

InChI=1S/C16H17IN2O2/c1-11-4-6-19(7-5-11)16(21)13(10-18)8-12-2-3-15(20)14(17)9-12/h2-3,8-9,11,20H,4-7H2,1H3/b13-8-