(2S,3R)-3-azanyl-1-(benzotriazol-1-yl)-4-phenyl-butan-2-ol hydrochloride

Systemtic Name: (2S,3R)-3-azanyl-1-(benzotriazol-1-yl)-4-phenyl-butan-2-ol hydrochloride Openeye Name: (2S,3R)-3-amino-1-(benzotriazol-1-yl)-4-phenyl-butan-2-ol hydrochloride CAS Name: (2S,3R)-3-amino-1-(1-benzotriazolyl)-4-phenyl-2-butanol hydrochloride IUPAC Name: (2S,3R)-3-amino-1-(benzotriazol-1-yl)-4-phenylbutan-2-ol hydrochloride Traditional Name: (2S,3R)-3-amino-1-(benzotriazol-1-yl)-4-phenyl-butan-2-ol hydrochloride Formula: C16H19ClN4O MolecularWeight: 318.80126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(CN2C3=CC=CC=C3N=N2)O)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)C[C@H]([C@H](CN2C3=CC=CC=C3N=N2)O)N.Cl

InChI

InChI=1S/C16H18N4O.ClH/c17-13(10-12-6-2-1-3-7-12)16(21)11-20-15-9-5-4-8-14(15)18-19-20;/h1-9,13,16,21H,10-11,17H2;1H/t13-,16+;/m1./s1