1-[(3-azanyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-piperidin-1-yl-propan-2-ol

Systemtic Name: 1-[(3-azanyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-piperidin-1-yl-propan-2-ol Openeye Name: 1-[(3-amino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-(1-piperidyl)propan-2-ol CAS Name: 1-[(3-amino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-(1-piperidinyl)-2-propanol IUPAC Name: 1-[(3-amino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-piperidin-1-ylpropan-2-ol Traditional Name: 1-[(3-amino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]-3-piperidino-propan-2-ol Formula: C15H21N5O3 MolecularWeight: 319.35894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(COC2=CC3=C(C=C2)N=C(N=[N+]3[O-])N)O

Isomeric SMILES

C1CCN(CC1)CC(COC2=CC3=C(C=C2)N=C(N=[N+]3[O-])N)O

InChI

InChI=1S/C15H21N5O3/c16-15-17-13-5-4-12(8-14(13)20(22)18-15)23-10-11(21)9-19-6-2-1-3-7-19/h4-5,8,11,21H,1-3,6-7,9-10H2,(H2,16,17,18)