N-[(R)-benzotriazol-1-yl-(4-chlorophenyl)methyl]pyridin-1-ium-2-amine

Systemtic Name: N-[(R)-benzotriazol-1-yl-(4-chlorophenyl)methyl]pyridin-1-ium-2-amine Openeye Name: N-[(R)-benzotriazol-1-yl-(4-chlorophenyl)methyl]pyridin-1-ium-2-amine CAS Name: N-[(R)-1-benzotriazolyl-(4-chlorophenyl)methyl]-2-pyridin-1-iumamine IUPAC Name: N-[(R)-benzotriazol-1-yl-(4-chlorophenyl)methyl]pyridin-1-ium-2-amine Traditional Name: [(R)-benzotriazol-1-yl-(4-chlorophenyl)methyl]-pyridin-1-ium-2-yl-amine Formula: C18H15ClN5+ MolecularWeight: 336.7982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(C3=CC=C(C=C3)Cl)NC4=CC=CC=[NH+]4

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2[C@H](C3=CC=C(C=C3)Cl)NC4=CC=CC=[NH+]4

InChI

InChI=1S/C18H14ClN5/c19-14-10-8-13(9-11-14)18(21-17-7-3-4-12-20-17)24-16-6-2-1-5-15(16)22-23-24/h1-12,18H,(H,20,21)/p+1/t18-/m1/s1