methyl 5-azanyl-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-azanyl-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-amino-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate CAS Name: 5-amino-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-amino-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-amino-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C16H17F3N2O2 MolecularWeight: 326.31359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)N)C2=CC=CC=C2C(F)(F)F)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)N)C2=CC=CC=C2C(F)(F)F)C(=O)OC

InChI

InChI=1S/C16H17F3N2O2/c1-8-12(15(22)23-3)13(14(20)9(2)21-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,21H,20H2,1-3H3