1-[(1S)-2-methyl-1-pyrrolidin-1-ium-1-yl-propyl]benzotriazole

Systemtic Name: 1-[(1S)-2-methyl-1-pyrrolidin-1-ium-1-yl-propyl]benzotriazole Openeye Name: 1-[(1S)-2-methyl-1-pyrrolidin-1-ium-1-yl-propyl]benzotriazole CAS Name: 1-[(1S)-2-methyl-1-(1-pyrrolidin-1-iumyl)propyl]benzotriazole IUPAC Name: 1-[(1S)-2-methyl-1-pyrrolidin-1-ium-1-ylpropyl]benzotriazole Traditional Name: 1-[(1S)-2-methyl-1-pyrrolidin-1-ium-1-yl-propyl]benzotriazole Formula: C14H21N4+ MolecularWeight: 245.34334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C([NH+]1CCCC1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)[C@@H]([NH+]1CCCC1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C14H20N4/c1-11(2)14(17-9-5-6-10-17)18-13-8-4-3-7-12(13)15-16-18/h3-4,7-8,11,14H,5-6,9-10H2,1-2H3/p+1/t14-/m0/s1