5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)carbonyl-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione

Systemtic Name: 5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)carbonyl-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Openeye Name: 5-(3,4-dimethoxyphenyl)-4-(4-methoxybenzoyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione CAS Name: 5-(3,4-dimethoxyphenyl)-4-[(4-methoxyphenyl)-oxomethyl]-1-[3-(4-morpholin-4-iumyl)propyl]pyrrolidine-2,3-dione IUPAC Name: 5-(3,4-dimethoxyphenyl)-4-(4-methoxybenzoyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Traditional Name: 5-(3,4-dimethoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)-4-p-anisoyl-pyrrolidine-2,3-quinone Formula: C27H33N2O7+ MolecularWeight: 497.56012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CCC[NH+]3CCOCC3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CCC[NH+]3CCOCC3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H32N2O7/c1-33-20-8-5-18(6-9-20)25(30)23-24(19-7-10-21(34-2)22(17-19)35-3)29(27(32)26(23)31)12-4-11-28-13-15-36-16-14-28/h5-10,17,23-24H,4,11-16H2,1-3H3/p+1