(3-azanyl-4-phenethyl-1,2-dihydropyridin-2-yl) 3,3-dimethyl-2-oxidanylidene-butanoate

Systemtic Name: (3-azanyl-4-phenethyl-1,2-dihydropyridin-2-yl) 3,3-dimethyl-2-oxidanylidene-butanoate Openeye Name: (3-amino-4-phenethyl-1,2-dihydropyridin-2-yl) 3,3-dimethyl-2-oxo-butanoate CAS Name: 3,3-dimethyl-2-oxobutanoic acid (3-amino-4-phenethyl-1,2-dihydropyridin-2-yl) ester IUPAC Name: (3-amino-4-phenethyl-1,2-dihydropyridin-2-yl) 3,3-dimethyl-2-oxobutanoate Traditional Name: 2-keto-3,3-dimethyl-butyric acid (3-amino-4-phenethyl-1,2-dihydropyridin-2-yl) ester Formula: C19H24N2O3 MolecularWeight: 328.40546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=O)OC1C(=C(C=CN1)CCC2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)C(=O)C(=O)OC1C(=C(C=CN1)CCC2=CC=CC=C2)N

InChI

InChI=1S/C19H24N2O3/c1-19(2,3)16(22)18(23)24-17-15(20)14(11-12-21-17)10-9-13-7-5-4-6-8-13/h4-8,11-12,17,21H,9-10,20H2,1-3H3