ethyl (2S)-2-[[(Z)-2-cyano-2-phenyl-ethenyl]amino]-4-methyl-pentanoate

Systemtic Name: ethyl (2S)-2-[[(Z)-2-cyano-2-phenyl-ethenyl]amino]-4-methyl-pentanoate Openeye Name: ethyl (2S)-2-[[(Z)-2-cyano-2-phenyl-vinyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(Z)-2-cyano-2-phenylethenyl]amino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[(Z)-2-cyano-2-phenylethenyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(Z)-2-cyano-2-phenyl-vinyl]amino]-4-methyl-valeric acid ethyl ester Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC=C(C#N)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)[C@H](CC(C)C)N/C=C(\C#N)/C1=CC=CC=C1

InChI

InChI=1S/C17H22N2O2/c1-4-21-17(20)16(10-13(2)3)19-12-15(11-18)14-8-6-5-7-9-14/h5-9,12-13,16,19H,4,10H2,1-3H3/b15-12+/t16-/m0/s1