7-[(phenylmethyl)amino]hept-1-en-3-yl ethanoate

Systemtic Name: 7-[(phenylmethyl)amino]hept-1-en-3-yl ethanoate Openeye Name: [5-(benzylamino)-1-vinyl-pentyl] acetate CAS Name: acetic acid 7-[(phenylmethyl)amino]hept-1-en-3-yl ester IUPAC Name: 7-(benzylamino)hept-1-en-3-yl acetate Traditional Name: acetic acid 1-[4-(benzylamino)butyl]allyl ester Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCCCNCC1=CC=CC=C1)C=C

Isomeric SMILES

CC(=O)OC(CCCCNCC1=CC=CC=C1)C=C

InChI

InChI=1S/C16H23NO2/c1-3-16(19-14(2)18)11-7-8-12-17-13-15-9-5-4-6-10-15/h3-6,9-10,16-17H,1,7-8,11-13H2,2H3