2-methylidene-4-[(phenylmethyl)-prop-2-enyl-amino]butanenitrile

Systemtic Name: 2-methylidene-4-[(phenylmethyl)-prop-2-enyl-amino]butanenitrile Openeye Name: 4-[allyl(benzyl)amino]-2-methylene-butanenitrile CAS Name: 2-methylene-4-[(phenylmethyl)-prop-2-enylamino]butanenitrile IUPAC Name: 4-[benzyl(prop-2-enyl)amino]-2-methylidenebutanenitrile Traditional Name: 2-[2-[allyl(benzyl)amino]ethyl]acrylonitrile Formula: C15H18N2 MolecularWeight: 226.31682

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CCC(=C)C#N)CC1=CC=CC=C1

Isomeric SMILES

C=CCN(CCC(=C)C#N)CC1=CC=CC=C1

InChI

InChI=1S/C15H18N2/c1-3-10-17(11-9-14(2)12-16)13-15-7-5-4-6-8-15/h3-8H,1-2,9-11,13H2