(6-phenoxypyridin-2-yl)methyl 2-cyano-2-[(4-ethoxyphenyl)amino]-3-methyl-butanoate

Systemtic Name: (6-phenoxypyridin-2-yl)methyl 2-cyano-2-[(4-ethoxyphenyl)amino]-3-methyl-butanoate Openeye Name: (6-phenoxy-2-pyridyl)methyl 2-cyano-2-(4-ethoxyanilino)-3-methyl-butanoate CAS Name: 2-cyano-2-(4-ethoxyanilino)-3-methylbutanoic acid (6-phenoxy-2-pyridinyl)methyl ester IUPAC Name: (6-phenoxypyridin-2-yl)methyl 2-cyano-2-(4-ethoxyanilino)-3-methylbutanoate Traditional Name: 2-cyano-3-methyl-2-(p-phenetidino)butyric acid (6-phenoxy-2-pyridyl)methyl ester Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(C#N)(C(C)C)C(=O)OCC2=NC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(C#N)(C(C)C)C(=O)OCC2=NC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O4/c1-4-31-22-15-13-20(14-16-22)29-26(18-27,19(2)3)25(30)32-17-21-9-8-12-24(28-21)33-23-10-6-5-7-11-23/h5-16,19,29H,4,17H2,1-3H3