1-[(3S)-3-methylpiperidin-1-yl]-3-piperazin-4-ium-1-yl-propan-1-one

Systemtic Name: 1-[(3S)-3-methylpiperidin-1-yl]-3-piperazin-4-ium-1-yl-propan-1-one Openeye Name: 1-[(3S)-3-methyl-1-piperidyl]-3-piperazin-4-ium-1-yl-propan-1-one CAS Name: 1-[(3S)-3-methyl-1-piperidinyl]-3-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: 1-[(3S)-3-methylpiperidin-1-yl]-3-piperazin-4-ium-1-ylpropan-1-one Traditional Name: 1-[(3S)-3-methylpiperidino]-3-piperazin-4-ium-1-yl-propan-1-one Formula: C13H26N3O+ MolecularWeight: 240.36504

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CCN2CC[NH2+]CC2

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CCN2CC[NH2+]CC2

InChI

InChI=1S/C13H25N3O/c1-12-3-2-7-16(11-12)13(17)4-8-15-9-5-14-6-10-15/h12,14H,2-11H2,1H3/p+1/t12-/m0/s1