3-[1-(piperidin-1-ium-1-ylmethyl)indol-3-yl]-1-piperidin-1-yl-propan-1-one

Systemtic Name: 3-[1-(piperidin-1-ium-1-ylmethyl)indol-3-yl]-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[1-(piperidin-1-ium-1-ylmethyl)indol-3-yl]-1-(1-piperidyl)propan-1-one CAS Name: 3-[1-(1-piperidin-1-iumylmethyl)-3-indolyl]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[1-(piperidin-1-ium-1-ylmethyl)indol-3-yl]-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[1-(piperidin-1-ium-1-ylmethyl)indol-3-yl]-1-piperidino-propan-1-one Formula: C22H32N3O+ MolecularWeight: 354.50898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN2C=C(C3=CC=CC=C32)CCC(=O)N4CCCCC4

Isomeric SMILES

C1CC[NH+](CC1)CN2C=C(C3=CC=CC=C32)CCC(=O)N4CCCCC4

InChI

InChI=1S/C22H31N3O/c26-22(24-15-7-2-8-16-24)12-11-19-17-25(18-23-13-5-1-6-14-23)21-10-4-3-9-20(19)21/h3-4,9-10,17H,1-2,5-8,11-16,18H2/p+1