1-chloranyl-8,8-dimethyl-4-oxidanylidene-3-(propan-2-ylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid

Systemtic Name: 1-chloranyl-8,8-dimethyl-4-oxidanylidene-3-(propan-2-ylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Openeye Name: 1-chloro-3-(isopropylamino)-8,8-dimethyl-4-oxo-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid CAS Name: 1-chloro-8,8-dimethyl-4-oxo-3-(propan-2-ylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid IUPAC Name: 1-chloro-8,8-dimethyl-4-oxo-3-(propan-2-ylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Traditional Name: 1-chloro-3-(isopropylamino)-4-keto-8,8-dimethyl-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Formula: C13H18ClN3O3 MolecularWeight: 299.75332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC(=C2C(CC(N2C1=O)C(=O)O)(C)C)Cl

Isomeric SMILES

CC(C)NC1=NC(=C2C(CC(N2C1=O)C(=O)O)(C)C)Cl

InChI

InChI=1S/C13H18ClN3O3/c1-6(2)15-10-11(18)17-7(12(19)20)5-13(3,4)8(17)9(14)16-10/h6-7H,5H2,1-4H3,(H,15,16)(H,19,20)