6-[(phenylmethyl)amino]-3-prop-1-en-2-yl-heptanenitrile

Systemtic Name: 6-[(phenylmethyl)amino]-3-prop-1-en-2-yl-heptanenitrile Openeye Name: 6-(benzylamino)-3-isopropenyl-heptanenitrile CAS Name: 3-(1-methylethenyl)-6-[(phenylmethyl)amino]heptanenitrile IUPAC Name: 6-(benzylamino)-3-prop-1-en-2-ylheptanenitrile Traditional Name: 3-[3-(benzylamino)butyl]-4-methyl-pent-4-enenitrile Formula: C17H24N2 MolecularWeight: 256.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CC#N)C(=C)C)NCC1=CC=CC=C1

Isomeric SMILES

CC(CCC(CC#N)C(=C)C)NCC1=CC=CC=C1

InChI

InChI=1S/C17H24N2/c1-14(2)17(11-12-18)10-9-15(3)19-13-16-7-5-4-6-8-16/h4-8,15,17,19H,1,9-11,13H2,2-3H3