(1R,2R)-2-(azocan-1-ium-1-yl)-1-(4-methylphenyl)propan-1-amine

Systemtic Name: (1R,2R)-2-(azocan-1-ium-1-yl)-1-(4-methylphenyl)propan-1-amine Openeye Name: (1R,2R)-2-(azocan-1-ium-1-yl)-1-(p-tolyl)propan-1-amine CAS Name: (1R,2R)-2-(1-azocan-1-iumyl)-1-(4-methylphenyl)-1-propanamine IUPAC Name: (1R,2R)-2-(azocan-1-ium-1-yl)-1-(4-methylphenyl)propan-1-amine Traditional Name: [(1R,2R)-2-(azocan-1-ium-1-yl)-1-(p-tolyl)propyl]amine Formula: C17H29N2+ MolecularWeight: 261.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C)[NH+]2CCCCCCC2)N

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]([C@@H](C)[NH+]2CCCCCCC2)N

InChI

InChI=1S/C17H28N2/c1-14-8-10-16(11-9-14)17(18)15(2)19-12-6-4-3-5-7-13-19/h8-11,15,17H,3-7,12-13,18H2,1-2H3/p+1/t15-,17+/m1/s1