1-[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]pyrrolidin-2-one

Systemtic Name: 1-[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]pyrrolidin-2-one Openeye Name: 1-[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one CAS Name: 1-[2-[[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[2-(4-veratrylpiperazin-4-ium-1-carbonyl)phenyl]-2-pyrrolidone Formula: C24H30N3O4+ MolecularWeight: 424.5127

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3N4CCCC4=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3N4CCCC4=O)OC

InChI

InChI=1S/C24H29N3O4/c1-30-21-10-9-18(16-22(21)31-2)17-25-12-14-26(15-13-25)24(29)19-6-3-4-7-20(19)27-11-5-8-23(27)28/h3-4,6-7,9-10,16H,5,8,11-15,17H2,1-2H3/p+1