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

Systemtic Name: 1-chloranyl-8,8-dimethyl-4-oxidanylidene-3-(1-oxidanylpropan-2-ylamino)-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Openeye Name: 1-chloro-3-[(2-hydroxy-1-methyl-ethyl)amino]-8,8-dimethyl-4-oxo-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid CAS Name: 1-chloro-3-(1-hydroxypropan-2-ylamino)-8,8-dimethyl-4-oxo-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid IUPAC Name: 1-chloro-3-(1-hydroxypropan-2-ylamino)-8,8-dimethyl-4-oxo-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Traditional Name: 1-chloro-3-[(2-hydroxy-1-methyl-ethyl)amino]-4-keto-8,8-dimethyl-6,7-dihydropyrrolo[1,2-a]pyrazine-6-carboxylic acid Formula: C13H18ClN3O4 MolecularWeight: 315.75272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18ClN3O4/c1-6(5-18)15-10-11(19)17-7(12(20)21)4-13(2,3)8(17)9(14)16-10/h6-7,18H,4-5H2,1-3H3,(H,15,16)(H,20,21)