(3S)-N-(3,4-dimethylphenyl)-1-(pyridin-3-ylmethyl)piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-(3,4-dimethylphenyl)-1-(pyridin-3-ylmethyl)piperidin-1-ium-3-amine Openeye Name: (3S)-N-(3,4-dimethylphenyl)-1-(3-pyridylmethyl)piperidin-1-ium-3-amine CAS Name: (3S)-N-(3,4-dimethylphenyl)-1-(3-pyridinylmethyl)-3-piperidin-1-iumamine IUPAC Name: (3S)-N-(3,4-dimethylphenyl)-1-(pyridin-3-ylmethyl)piperidin-1-ium-3-amine Traditional Name: (3,4-dimethylphenyl)-[(3S)-1-(3-pyridylmethyl)piperidin-1-ium-3-yl]amine Formula: C19H26N3+ MolecularWeight: 296.42984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CCC[NH+](C2)CC3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@H]2CCC[NH+](C2)CC3=CN=CC=C3)C

InChI

InChI=1S/C19H25N3/c1-15-7-8-18(11-16(15)2)21-19-6-4-10-22(14-19)13-17-5-3-9-20-12-17/h3,5,7-9,11-12,19,21H,4,6,10,13-14H2,1-2H3/p+1/t19-/m0/s1