methyl (E)-2-cyano-5-methyl-2-(3-phenylazanylpropyl)hex-3-enoate

Systemtic Name: methyl (E)-2-cyano-5-methyl-2-(3-phenylazanylpropyl)hex-3-enoate Openeye Name: methyl (E)-2-(3-anilinopropyl)-2-cyano-5-methyl-hex-3-enoate CAS Name: (E)-2-(3-anilinopropyl)-2-cyano-5-methyl-3-hexenoic acid methyl ester IUPAC Name: methyl (E)-2-(3-anilinopropyl)-2-cyano-5-methylhex-3-enoate Traditional Name: (E)-2-(3-anilinopropyl)-2-cyano-5-methyl-hex-3-enoic acid methyl ester Formula: C18H24N2O2 MolecularWeight: 300.39536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=CC(CCCNC1=CC=CC=C1)(C#N)C(=O)OC

Isomeric SMILES

CC(C)/C=C/C(CCCNC1=CC=CC=C1)(C#N)C(=O)OC

InChI

InChI=1S/C18H24N2O2/c1-15(2)10-12-18(14-19,17(21)22-3)11-7-13-20-16-8-5-4-6-9-16/h4-6,8-10,12,15,20H,7,11,13H2,1-3H3/b12-10+