benzotriazol-1-ylmethyl-[(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]azanium

Systemtic Name: benzotriazol-1-ylmethyl-[(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]azanium Openeye Name: benzotriazol-1-ylmethyl-[(1S)-2-(benzylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: 1-benzotriazolylmethyl-[(2S)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]ammonium IUPAC Name: benzotriazol-1-ylmethyl-[(2S)-1-(benzylamino)-1-oxopropan-2-yl]azanium Traditional Name: benzotriazol-1-ylmethyl-[(1S)-2-(benzylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C17H20N5O+ MolecularWeight: 310.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)[NH2+]CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CC=C1)[NH2+]CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H19N5O/c1-13(17(23)18-11-14-7-3-2-4-8-14)19-12-22-16-10-6-5-9-15(16)20-21-22/h2-10,13,19H,11-12H2,1H3,(H,18,23)/p+1/t13-/m0/s1