(4R)-1-(4-ethoxyphenyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-pyrrolidin-2-one

Systemtic Name: (4R)-1-(4-ethoxyphenyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-pyrrolidin-2-one Openeye Name: (4R)-4-(4-benzylpiperazin-4-ium-1-carbonyl)-1-(4-ethoxyphenyl)pyrrolidin-2-one CAS Name: (4R)-1-(4-ethoxyphenyl)-4-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]-2-pyrrolidinone IUPAC Name: (4R)-4-(4-benzylpiperazin-4-ium-1-carbonyl)-1-(4-ethoxyphenyl)pyrrolidin-2-one Traditional Name: (4R)-4-(4-benzylpiperazin-4-ium-1-carbonyl)-1-p-phenetyl-2-pyrrolidone Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O3/c1-2-30-22-10-8-21(9-11-22)27-18-20(16-23(27)28)24(29)26-14-12-25(13-15-26)17-19-6-4-3-5-7-19/h3-11,20H,2,12-18H2,1H3/p+1/t20-/m1/s1