methyl (E)-4-methyl-4-[(phenylmethyl)amino]hex-2-enoate

Systemtic Name: methyl (E)-4-methyl-4-[(phenylmethyl)amino]hex-2-enoate Openeye Name: methyl (E)-4-(benzylamino)-4-methyl-hex-2-enoate CAS Name: (E)-4-methyl-4-[(phenylmethyl)amino]-2-hexenoic acid methyl ester IUPAC Name: methyl (E)-4-(benzylamino)-4-methylhex-2-enoate Traditional Name: (E)-4-(benzylamino)-4-methyl-hex-2-enoic acid methyl ester Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C=CC(=O)OC)NCC1=CC=CC=C1

Isomeric SMILES

CCC(C)(/C=C/C(=O)OC)NCC1=CC=CC=C1

InChI

InChI=1S/C15H21NO2/c1-4-15(2,11-10-14(17)18-3)16-12-13-8-6-5-7-9-13/h5-11,16H,4,12H2,1-3H3/b11-10+