4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-1-piperidin-1-yl-butan-1-one

Systemtic Name: 4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-1-piperidin-1-yl-butan-1-one Openeye Name: 4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-1-(1-piperidyl)butan-1-one CAS Name: 4-(1-methyl-1-piperidin-1-iumyl)-2,2-diphenyl-1-(1-piperidinyl)-1-butanone IUPAC Name: 4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-1-piperidin-1-ylbutan-1-one Traditional Name: 4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-1-piperidino-butan-1-one Formula: C27H37N2O+ MolecularWeight: 405.59548

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N4CCCCC4

Isomeric SMILES

C[N+]1(CCCCC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C27H37N2O/c1-29(21-12-5-13-22-29)23-18-27(24-14-6-2-7-15-24,25-16-8-3-9-17-25)26(30)28-19-10-4-11-20-28/h2-3,6-9,14-17H,4-5,10-13,18-23H2,1H3/q+1