(4R)-4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]carbonyl-1-(4-methylphenyl)pyrrolidin-2-one

Systemtic Name: (4R)-4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]carbonyl-1-(4-methylphenyl)pyrrolidin-2-one Openeye Name: (4R)-4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-carbonyl]-1-(p-tolyl)pyrrolidin-2-one CAS Name: (4R)-4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-4-iumyl]-oxomethyl]-1-(4-methylphenyl)-2-pyrrolidinone IUPAC Name: (4R)-4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-carbonyl]-1-(4-methylphenyl)pyrrolidin-2-one Traditional Name: (4R)-4-(4-piperonylpiperazin-4-ium-1-carbonyl)-1-(p-tolyl)-2-pyrrolidone Formula: C24H28N3O4+ MolecularWeight: 422.49682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H27N3O4/c1-17-2-5-20(6-3-17)27-15-19(13-23(27)28)24(29)26-10-8-25(9-11-26)14-18-4-7-21-22(12-18)31-16-30-21/h2-7,12,19H,8-11,13-16H2,1H3/p+1/t19-/m1/s1