3-methyl-5-(methylcarbamoyl)-8-nitro-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylic acid

Systemtic Name: 3-methyl-5-(methylcarbamoyl)-8-nitro-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylic acid Openeye Name: 3-methyl-5-(methylcarbamoyl)-8-nitro-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylic acid CAS Name: 3-methyl-5-(methylcarbamoyl)-8-nitro-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylic acid IUPAC Name: 3-methyl-5-(methylcarbamoyl)-8-nitro-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylic acid Traditional Name: 3-methyl-5-(methylcarbamoyl)-8-nitro-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylic acid Formula: C16H20N4O5 MolecularWeight: 348.3538

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1(CC2=C(C=CC(=C2)[N+](=O)[O-])N3C1CN(CC3)C)C(=O)O

Isomeric SMILES

CNC(=O)C1(CC2=C(C=CC(=C2)[N+](=O)[O-])N3C1CN(CC3)C)C(=O)O

InChI

InChI=1S/C16H20N4O5/c1-17-14(21)16(15(22)23)8-10-7-11(20(24)25)3-4-12(10)19-6-5-18(2)9-13(16)19/h3-4,7,13H,5-6,8-9H2,1-2H3,(H,17,21)(H,22,23)