[1-[(3-azanylidene-1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-piperidin-1-yl-propan-2-yl] ethanoate

Systemtic Name: [1-[(3-azanylidene-1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-piperidin-1-yl-propan-2-yl] ethanoate Openeye Name: [1-[(4-hydroxy-3-imino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxymethyl]-2-(1-piperidyl)ethyl] acetate CAS Name: acetic acid [1-[(4-hydroxy-3-imino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-(1-piperidinyl)propan-2-yl] ester IUPAC Name: [1-[(4-hydroxy-3-imino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-piperidin-1-ylpropan-2-yl] acetate Traditional Name: acetic acid [1-[(4-hydroxy-3-imino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxymethyl]-2-piperidino-ethyl] ester Formula: C17H23N5O5 MolecularWeight: 377.39502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CN1CCCCC1)COC2=CC3=C(C=C2)N(C(=N)N=[N+]3[O-])O

Isomeric SMILES

CC(=O)OC(CN1CCCCC1)COC2=CC3=C(C=C2)N(C(=N)N=[N+]3[O-])O

InChI

InChI=1S/C17H23N5O5/c1-12(23)27-14(10-20-7-3-2-4-8-20)11-26-13-5-6-15-16(9-13)22(25)19-17(18)21(15)24/h5-6,9,14,18,24H,2-4,7-8,10-11H2,1H3