ethyl 2-cyano-3-[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]imino-propanoate

Systemtic Name: ethyl 2-cyano-3-[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]imino-propanoate Openeye Name: ethyl 2-cyano-3-[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]imino-propanoate CAS Name: 2-cyano-3-[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]iminopropanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]iminopropanoate Traditional Name: 2-cyano-3-[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]imino-propionic acid ethyl ester Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CN=CC(C#N)C(=O)OCC)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CN=CC(C#N)C(=O)OCC)N(C)C

InChI

InChI=1S/C18H25N3O2/c1-5-14-7-9-15(10-8-14)17(21(3)4)13-20-12-16(11-19)18(22)23-6-2/h7-10,12,16-17H,5-6,13H2,1-4H3/t16?,17-/m0/s1