3-(1H-imidazol-5-ylmethyl)-5-(methylaminomethyl)-7-nitro-3,4-dihydro-1H-quinoxalin-2-one

Systemtic Name: 3-(1H-imidazol-5-ylmethyl)-5-(methylaminomethyl)-7-nitro-3,4-dihydro-1H-quinoxalin-2-one Openeye Name: 3-(1H-imidazol-5-ylmethyl)-5-(methylaminomethyl)-7-nitro-3,4-dihydro-1H-quinoxalin-2-one CAS Name: 3-(1H-imidazol-5-ylmethyl)-5-(methylaminomethyl)-7-nitro-3,4-dihydro-1H-quinoxalin-2-one IUPAC Name: 3-(1H-imidazol-5-ylmethyl)-5-(methylaminomethyl)-7-nitro-3,4-dihydro-1H-quinoxalin-2-one Traditional Name: 3-(1H-imidazol-5-ylmethyl)-5-(methylaminomethyl)-7-nitro-3,4-dihydro-1H-quinoxalin-2-one Formula: C14H16N6O3 MolecularWeight: 316.31524

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC(=CC2=C1NC(C(=O)N2)CC3=CN=CN3)[N+](=O)[O-]

Isomeric SMILES

CNCC1=CC(=CC2=C1NC(C(=O)N2)CC3=CN=CN3)[N+](=O)[O-]

InChI

InChI=1S/C14H16N6O3/c1-15-5-8-2-10(20(22)23)4-11-13(8)18-12(14(21)19-11)3-9-6-16-7-17-9/h2,4,6-7,12,15,18H,3,5H2,1H3,(H,16,17)(H,19,21)