[(3-cyano-4-phenyl-phenyl)-methyl-amino]methyl 2-ethyl-3-methyl-butanoate

Systemtic Name: [(3-cyano-4-phenyl-phenyl)-methyl-amino]methyl 2-ethyl-3-methyl-butanoate Openeye Name: (3-cyano-N-methyl-4-phenyl-anilino)methyl 2-ethyl-3-methyl-butanoate CAS Name: 2-ethyl-3-methylbutanoic acid (3-cyano-N-methyl-4-phenylanilino)methyl ester IUPAC Name: (3-cyano-N-methyl-4-phenylanilino)methyl 2-ethyl-3-methylbutanoate Traditional Name: 2-ethyl-3-methyl-butyric acid (3-cyano-N-methyl-4-phenyl-anilino)methyl ester Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C)C(=O)OCN(C)C1=CC(=C(C=C1)C2=CC=CC=C2)C#N

Isomeric SMILES

CCC(C(C)C)C(=O)OCN(C)C1=CC(=C(C=C1)C2=CC=CC=C2)C#N

InChI

InChI=1S/C22H26N2O2/c1-5-20(16(2)3)22(25)26-15-24(4)19-11-12-21(18(13-19)14-23)17-9-7-6-8-10-17/h6-13,16,20H,5,15H2,1-4H3