[4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-yl]-phenyl-methanone

Systemtic Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-yl]-phenyl-methanone Openeye Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-1-piperidyl]-phenyl-methanone CAS Name: [4-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-1-piperidinyl]-phenylmethanone IUPAC Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-yl]-phenylmethanone Traditional Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]piperidino]-phenyl-methanone Formula: C19H29N2O+ MolecularWeight: 301.44636

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)C2CCN(CC2)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)C2CCN(CC2)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C19H28N2O/c1-15-12-16(2)14-21(13-15)18-8-10-20(11-9-18)19(22)17-6-4-3-5-7-17/h3-7,15-16,18H,8-14H2,1-2H3/p+1/t15-,16-/m1/s1