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

Systemtic Name: 3-(hydroxymethyl)-7-nitro-5-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-quinoxalin-2-one Openeye Name: 3-(hydroxymethyl)-7-nitro-5-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-quinoxalin-2-one CAS Name: 3-(hydroxymethyl)-7-nitro-5-(1-pyrrolidinylmethyl)-3,4-dihydro-1H-quinoxalin-2-one IUPAC Name: 3-(hydroxymethyl)-7-nitro-5-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-quinoxalin-2-one Traditional Name: 3-methylol-7-nitro-5-(pyrrolidinomethyl)-3,4-dihydro-1H-quinoxalin-2-one Formula: C14H18N4O4 MolecularWeight: 306.31712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC3=C2NC(C(=O)N3)CO)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC3=C2NC(C(=O)N3)CO)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O4/c19-8-12-14(20)16-11-6-10(18(21)22)5-9(13(11)15-12)7-17-3-1-2-4-17/h5-6,12,15,19H,1-4,7-8H2,(H,16,20)