[(3R)-3-methylpiperidin-1-yl]-[1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: [(3R)-3-methylpiperidin-1-yl]-[1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: [1-[(4-isopropylphenyl)methyl]piperidin-1-ium-4-yl]-[(3R)-3-methyl-1-piperidyl]methanone CAS Name: [(3R)-3-methyl-1-piperidinyl]-[1-[(4-propan-2-ylphenyl)methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: [(3R)-3-methylpiperidin-1-yl]-[1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: [1-(4-isopropylbenzyl)piperidin-1-ium-4-yl]-[(3R)-3-methylpiperidino]methanone Formula: C22H35N2O+ MolecularWeight: 343.5261

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H34N2O/c1-17(2)20-8-6-19(7-9-20)16-23-13-10-21(11-14-23)22(25)24-12-4-5-18(3)15-24/h6-9,17-18,21H,4-5,10-16H2,1-3H3/p+1/t18-/m1/s1