3-[(3R)-1-[1-(3-methoxyphenyl)piperidin-4-yl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[(3R)-1-[1-(3-methoxyphenyl)piperidin-4-yl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[(3R)-1-[1-(3-methoxyphenyl)-4-piperidyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[(3R)-1-[1-(3-methoxyphenyl)-4-piperidinyl]-3-piperidin-1-iumyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[(3R)-1-[1-(3-methoxyphenyl)piperidin-4-yl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[(3R)-1-[1-(3-methoxyphenyl)-4-piperidyl]piperidin-1-ium-3-yl]-1-pyrrolidino-propan-1-one Formula: C24H38N3O2+ MolecularWeight: 400.57742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCC(CC2)[NH+]3CCCC(C3)CCC(=O)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)N2CCC(CC2)[NH+]3CCC[C@@H](C3)CCC(=O)N4CCCC4

InChI

InChI=1S/C24H37N3O2/c1-29-23-8-4-7-22(18-23)25-16-11-21(12-17-25)27-15-5-6-20(19-27)9-10-24(28)26-13-2-3-14-26/h4,7-8,18,20-21H,2-3,5-6,9-17,19H2,1H3/p+1/t20-/m1/s1