1-[(3R)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]piperidin-1-yl]-5-phenyl-pentan-1-one

Systemtic Name: 1-[(3R)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]piperidin-1-yl]-5-phenyl-pentan-1-one Openeye Name: 1-[(3R)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxo-propyl]-1-piperidyl]-5-phenyl-pentan-1-one CAS Name: 1-[(3R)-3-[3-(4-methyl-1-piperazin-4-iumyl)-3-oxopropyl]-1-piperidinyl]-5-phenyl-1-pentanone IUPAC Name: 1-[(3R)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxopropyl]piperidin-1-yl]-5-phenylpentan-1-one Traditional Name: 1-[(3R)-3-[3-keto-3-(4-methylpiperazin-4-ium-1-yl)propyl]piperidino]-5-phenyl-pentan-1-one Formula: C24H38N3O2+ MolecularWeight: 400.57742

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CCC2CCCN(C2)C(=O)CCCCC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CC[C@H]2CCCN(C2)C(=O)CCCCC3=CC=CC=C3

InChI

InChI=1S/C24H37N3O2/c1-25-16-18-26(19-17-25)24(29)14-13-22-11-7-15-27(20-22)23(28)12-6-5-10-21-8-3-2-4-9-21/h2-4,8-9,22H,5-7,10-20H2,1H3/p+1/t22-/m1/s1