ethyl (3R,5R)-5-cyano-5-[(4-methoxyphenyl)amino]-2,2-dimethyl-3-phenyl-pentanoate

Systemtic Name: ethyl (3R,5R)-5-cyano-5-[(4-methoxyphenyl)amino]-2,2-dimethyl-3-phenyl-pentanoate Openeye Name: ethyl (3R,5R)-5-cyano-5-(4-methoxyanilino)-2,2-dimethyl-3-phenyl-pentanoate CAS Name: (3R,5R)-5-cyano-5-(4-methoxyanilino)-2,2-dimethyl-3-phenylpentanoic acid ethyl ester IUPAC Name: ethyl (3R,5R)-5-cyano-5-(4-methoxyanilino)-2,2-dimethyl-3-phenylpentanoate Traditional Name: (3R,5R)-5-cyano-2,2-dimethyl-5-(p-anisidino)-3-phenyl-valeric acid ethyl ester Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)C(CC(C#N)NC1=CC=C(C=C1)OC)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C)(C)[C@H](C[C@H](C#N)NC1=CC=C(C=C1)OC)C2=CC=CC=C2

InChI

InChI=1S/C23H28N2O3/c1-5-28-22(26)23(2,3)21(17-9-7-6-8-10-17)15-19(16-24)25-18-11-13-20(27-4)14-12-18/h6-14,19,21,25H,5,15H2,1-4H3/t19-,21-/m1/s1