2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C18H17N4O5+ MolecularWeight: 369.35138

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCNC3=C(C(=O)[N+]4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCNC3=C(C(=O)[N+]4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O5/c23-18-16(22(24)25)17(20-15-3-1-2-8-21(15)18)19-7-6-12-4-5-13-14(11-12)27-10-9-26-13/h1-5,8,11H,6-7,9-10H2,(H,19,23)/p+1