N-[(1R)-1-(benzotriazol-1-yl)-2-methyl-propyl]-5-bromanyl-pyridin-1-ium-2-amine

Systemtic Name: N-[(1R)-1-(benzotriazol-1-yl)-2-methyl-propyl]-5-bromanyl-pyridin-1-ium-2-amine Openeye Name: N-[(1R)-1-(benzotriazol-1-yl)-2-methyl-propyl]-5-bromo-pyridin-1-ium-2-amine CAS Name: N-[(1R)-1-(1-benzotriazolyl)-2-methylpropyl]-5-bromo-2-pyridin-1-iumamine IUPAC Name: N-[(1R)-1-(benzotriazol-1-yl)-2-methylpropyl]-5-bromopyridin-1-ium-2-amine Traditional Name: [(1R)-1-(benzotriazol-1-yl)-2-methyl-propyl]-(5-bromopyridin-1-ium-2-yl)amine Formula: C15H17BrN5+ MolecularWeight: 347.23298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(NC1=[NH+]C=C(C=C1)Br)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)[C@H](NC1=[NH+]C=C(C=C1)Br)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C15H16BrN5/c1-10(2)15(18-14-8-7-11(16)9-17-14)21-13-6-4-3-5-12(13)19-20-21/h3-10,15H,1-2H3,(H,17,18)/p+1/t15-/m1/s1