6-ethoxy-N-(3-morpholin-4-ylpropyl)-1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-amine

Systemtic Name: 6-ethoxy-N-(3-morpholin-4-ylpropyl)-1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-amine Openeye Name: 6-ethoxy-N-(3-morpholinopropyl)-1-oxido-1,2,4-benzotriazin-1-ium-3-amine CAS Name: 6-ethoxy-N-[3-(4-morpholinyl)propyl]-1-oxido-1,2,4-benzotriazin-1-ium-3-amine IUPAC Name: 6-ethoxy-N-(3-morpholin-4-ylpropyl)-1-oxido-1,2,4-benzotriazin-1-ium-3-amine Traditional Name: (6-ethoxy-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)-(3-morpholinopropyl)amine Formula: C16H23N5O3 MolecularWeight: 333.38552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[N+](=NC(=N2)NCCCN3CCOCC3)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)[N+](=NC(=N2)NCCCN3CCOCC3)[O-]

InChI

InChI=1S/C16H23N5O3/c1-2-24-13-4-5-15-14(12-13)18-16(19-21(15)22)17-6-3-7-20-8-10-23-11-9-20/h4-5,12H,2-3,6-11H2,1H3,(H,17,18,19)