(3R)-3-[2-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-piperazin-4-ium-2-one

Systemtic Name: (3R)-3-[2-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-piperazin-4-ium-2-one Openeye Name: (3R)-3-[2-[4-(3-methoxybenzoyl)piperazin-1-yl]-2-oxo-ethyl]-4-methyl-piperazin-4-ium-2-one CAS Name: (3R)-3-[2-[4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]-4-methyl-2-piperazin-4-iumone IUPAC Name: (3R)-3-[2-[4-(3-methoxybenzoyl)piperazin-1-yl]-2-oxoethyl]-4-methylpiperazin-4-ium-2-one Traditional Name: (3R)-3-[2-keto-2-(4-m-anisoylpiperazino)ethyl]-4-methyl-piperazin-4-ium-2-one Formula: C19H27N4O4+ MolecularWeight: 375.44208

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCNC(=O)C1CC(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+]1CCNC(=O)[C@H]1CC(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H26N4O4/c1-21-7-6-20-18(25)16(21)13-17(24)22-8-10-23(11-9-22)19(26)14-4-3-5-15(12-14)27-2/h3-5,12,16H,6-11,13H2,1-2H3,(H,20,25)/p+1/t16-/m1/s1