[1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]-[(3R)-3-methylpiperidin-1-yl]methanone

Systemtic Name: [1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]-[(3R)-3-methylpiperidin-1-yl]methanone Openeye Name: [1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]-[(3R)-3-methyl-1-piperidyl]methanone CAS Name: [1-[(3-bromophenyl)methyl]-4-piperidin-1-iumyl]-[(3R)-3-methyl-1-piperidinyl]methanone IUPAC Name: [1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]-[(3R)-3-methylpiperidin-1-yl]methanone Traditional Name: [1-(3-bromobenzyl)piperidin-1-ium-4-yl]-[(3R)-3-methylpiperidino]methanone Formula: C19H28BrN2O+ MolecularWeight: 380.34242

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2CC[NH+](CC2)CC3=CC(=CC=C3)Br

Isomeric SMILES

C[C@@H]1CCCN(C1)C(=O)C2CC[NH+](CC2)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H27BrN2O/c1-15-4-3-9-22(13-15)19(23)17-7-10-21(11-8-17)14-16-5-2-6-18(20)12-16/h2,5-6,12,15,17H,3-4,7-11,13-14H2,1H3/p+1/t15-/m1/s1