2-pyrrolidin-1-ylethyl 4-(4-cyanophenyl)-6-methyl-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylate

Systemtic Name: 2-pyrrolidin-1-ylethyl 4-(4-cyanophenyl)-6-methyl-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylate Openeye Name: 2-pyrrolidin-1-ylethyl 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylate CAS Name: 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid 2-(1-pyrrolidinyl)ethyl ester IUPAC Name: 2-pyrrolidin-1-ylethyl 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylate Traditional Name: 4-(4-cyanophenyl)-2-keto-6-methyl-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid 2-pyrrolidinoethyl ester Formula: C27H26F3N3O3 MolecularWeight: 497.50885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1C2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C=C3)C#N)C(=O)OCCN4CCCC4

Isomeric SMILES

CC1=C(C(CC(=O)N1C2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C=C3)C#N)C(=O)OCCN4CCCC4

InChI

InChI=1S/C27H26F3N3O3/c1-18-25(26(35)36-14-13-32-11-2-3-12-32)23(20-9-7-19(17-31)8-10-20)16-24(34)33(18)22-6-4-5-21(15-22)27(28,29)30/h4-10,15,23H,2-3,11-14,16H2,1H3