N-[(3R)-3-(benzotriazol-1-yl)butyl]pyridin-1-ium-4-amine

Systemtic Name: N-[(3R)-3-(benzotriazol-1-yl)butyl]pyridin-1-ium-4-amine Openeye Name: N-[(3R)-3-(benzotriazol-1-yl)butyl]pyridin-1-ium-4-amine CAS Name: N-[(3R)-3-(1-benzotriazolyl)butyl]-4-pyridin-1-iumamine IUPAC Name: N-[(3R)-3-(benzotriazol-1-yl)butyl]pyridin-1-ium-4-amine Traditional Name: [(3R)-3-(benzotriazol-1-yl)butyl]-pyridin-1-ium-4-yl-amine Formula: C15H18N5+ MolecularWeight: 268.33692

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNC1=CC=[NH+]C=C1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@H](CCNC1=CC=[NH+]C=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C15H17N5/c1-12(6-11-17-13-7-9-16-10-8-13)20-15-5-3-2-4-14(15)18-19-20/h2-5,7-10,12H,6,11H2,1H3,(H,16,17)/p+1/t12-/m1/s1