3-[2-[1-(3-nitropyridin-1-ium-2-yl)piperidin-4-ylidene]hydrazinyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[2-[1-(3-nitropyridin-1-ium-2-yl)piperidin-4-ylidene]hydrazinyl]-1H-quinoxalin-2-one Openeye Name: 3-[2-[1-(3-nitropyridin-1-ium-2-yl)-4-piperidylidene]hydrazino]-1H-quinoxalin-2-one CAS Name: 3-[2-[1-(3-nitro-2-pyridin-1-iumyl)-4-piperidinylidene]hydrazinyl]-1H-quinoxalin-2-one IUPAC Name: 3-[2-[1-(3-nitropyridin-1-ium-2-yl)piperidin-4-ylidene]hydrazinyl]-1H-quinoxalin-2-one Traditional Name: 3-[N'-[1-(3-nitropyridin-1-ium-2-yl)-4-piperidylidene]hydrazino]-1H-quinoxalin-2-one Formula: C18H18N7O3+ MolecularWeight: 380.38062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=NNC2=NC3=CC=CC=C3NC2=O)C4=C(C=CC=[NH+]4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1=NNC2=NC3=CC=CC=C3NC2=O)C4=C(C=CC=[NH+]4)[N+](=O)[O-]

InChI

InChI=1S/C18H17N7O3/c26-18-16(20-13-4-1-2-5-14(13)21-18)23-22-12-7-10-24(11-8-12)17-15(25(27)28)6-3-9-19-17/h1-6,9H,7-8,10-11H2,(H,20,23)(H,21,26)/p+1