8-azanyl-1-chloranyl-8-methyl-4-oxidanylidene-3-[[3-(trifluoromethyl)phenyl]methylamino]-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid

Systemtic Name: 8-azanyl-1-chloranyl-8-methyl-4-oxidanylidene-3-[[3-(trifluoromethyl)phenyl]methylamino]-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Openeye Name: 8-amino-1-chloro-8-methyl-4-oxo-3-[[3-(trifluoromethyl)phenyl]methylamino]-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid CAS Name: 8-amino-1-chloro-8-methyl-4-oxo-3-[[3-(trifluoromethyl)phenyl]methylamino]-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid IUPAC Name: 8-amino-1-chloro-8-methyl-4-oxo-3-[[3-(trifluoromethyl)phenyl]methylamino]-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Traditional Name: 8-amino-1-chloro-4-keto-8-methyl-3-[[3-(trifluoromethyl)benzyl]amino]-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Formula: C17H16ClF3N4O3 MolecularWeight: 416.78215

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(N2C1=C(N=C(C2=O)NCC3=CC(=CC=C3)C(F)(F)F)Cl)C(=O)O)N

Isomeric SMILES

CC1(CC(N2C1=C(N=C(C2=O)NCC3=CC(=CC=C3)C(F)(F)F)Cl)C(=O)O)N

InChI

InChI=1S/C17H16ClF3N4O3/c1-16(22)6-10(15(27)28)25-11(16)12(18)24-13(14(25)26)23-7-8-3-2-4-9(5-8)17(19,20)21/h2-5,10H,6-7,22H2,1H3,(H,23,24)(H,27,28)