3-(3-piperazin-4-ium-1-ylphenyl)-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-(3-piperazin-4-ium-1-ylphenyl)-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-(3-piperazin-4-ium-1-ylphenyl)-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[3-(1-piperazin-4-iumyl)phenyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-(3-piperazin-4-ium-1-ylphenyl)-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-(3-piperazin-4-ium-1-ylphenyl)-1-pyrrolidino-propan-1-one Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCC2=CC(=CC=C2)N3CC[NH2+]CC3

Isomeric SMILES

C1CCN(C1)C(=O)CCC2=CC(=CC=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C17H25N3O/c21-17(20-10-1-2-11-20)7-6-15-4-3-5-16(14-15)19-12-8-18-9-13-19/h3-5,14,18H,1-2,6-13H2/p+1