(E)-3-[4-[2-(hydroxymethyl)azepan-1-yl]phenyl]-2-methyl-prop-2-enenitrile

Systemtic Name: (E)-3-[4-[2-(hydroxymethyl)azepan-1-yl]phenyl]-2-methyl-prop-2-enenitrile Openeye Name: (E)-3-[4-[2-(hydroxymethyl)azepan-1-yl]phenyl]-2-methyl-prop-2-enenitrile CAS Name: (E)-3-[4-[2-(hydroxymethyl)-1-azepanyl]phenyl]-2-methyl-2-propenenitrile IUPAC Name: (E)-3-[4-[2-(hydroxymethyl)azepan-1-yl]phenyl]-2-methylprop-2-enenitrile Traditional Name: (E)-2-methyl-3-[4-(2-methylolazepan-1-yl)phenyl]acrylonitrile Formula: C17H22N2O MolecularWeight: 270.36938

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(C=C1)N2CCCCCC2CO)C#N

Isomeric SMILES

C/C(=C\C1=CC=C(C=C1)N2CCCCCC2CO)/C#N

InChI

InChI=1S/C17H22N2O/c1-14(12-18)11-15-6-8-16(9-7-15)19-10-4-2-3-5-17(19)13-20/h6-9,11,17,20H,2-5,10,13H2,1H3/b14-11+