6-nitro-3-oxidanylidene-8-(piperidin-1-ylmethyl)-2,4-dihydro-1H-quinoxaline-2-carboxylic acid

Systemtic Name: 6-nitro-3-oxidanylidene-8-(piperidin-1-ylmethyl)-2,4-dihydro-1H-quinoxaline-2-carboxylic acid Openeye Name: 6-nitro-3-oxo-8-(1-piperidylmethyl)-2,4-dihydro-1H-quinoxaline-2-carboxylic acid CAS Name: 6-nitro-3-oxo-8-(1-piperidinylmethyl)-2,4-dihydro-1H-quinoxaline-2-carboxylic acid IUPAC Name: 6-nitro-3-oxo-8-(piperidin-1-ylmethyl)-2,4-dihydro-1H-quinoxaline-2-carboxylic acid Traditional Name: 3-keto-6-nitro-8-(piperidinomethyl)-2,4-dihydro-1H-quinoxaline-2-carboxylic acid Formula: C15H18N4O5 MolecularWeight: 334.32722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC3=C2NC(C(=O)N3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC3=C2NC(C(=O)N3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O5/c20-14-13(15(21)22)17-12-9(8-18-4-2-1-3-5-18)6-10(19(23)24)7-11(12)16-14/h6-7,13,17H,1-5,8H2,(H,16,20)(H,21,22)