N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]-3-bromanyl-benzamide

Systemtic Name: N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]-3-bromanyl-benzamide Openeye Name: N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]-3-bromo-benzamide CAS Name: N-[(E)-1-(1-benzotriazolyl)propan-2-ylideneamino]-3-bromobenzamide IUPAC Name: N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]-3-bromobenzamide Traditional Name: N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]-3-bromo-benzamide Formula: C16H14BrN5O MolecularWeight: 372.21926

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)Br)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=CC=C1)Br)/CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H14BrN5O/c1-11(10-22-15-8-3-2-7-14(15)19-21-22)18-20-16(23)12-5-4-6-13(17)9-12/h2-9H,10H2,1H3,(H,20,23)/b18-11+