5-(2,5-dimethoxyphenyl)-4-(4-methoxy-2-methyl-phenyl)carbonyl-1-(2-morpholin-4-ium-4-ylethyl)pyrrolidine-2,3-dione

Systemtic Name: 5-(2,5-dimethoxyphenyl)-4-(4-methoxy-2-methyl-phenyl)carbonyl-1-(2-morpholin-4-ium-4-ylethyl)pyrrolidine-2,3-dione Openeye Name: 5-(2,5-dimethoxyphenyl)-4-(4-methoxy-2-methyl-benzoyl)-1-(2-morpholin-4-ium-4-ylethyl)pyrrolidine-2,3-dione CAS Name: 5-(2,5-dimethoxyphenyl)-4-[(4-methoxy-2-methylphenyl)-oxomethyl]-1-[2-(4-morpholin-4-iumyl)ethyl]pyrrolidine-2,3-dione IUPAC Name: 5-(2,5-dimethoxyphenyl)-4-(4-methoxy-2-methylbenzoyl)-1-(2-morpholin-4-ium-4-ylethyl)pyrrolidine-2,3-dione Traditional Name: 5-(2,5-dimethoxyphenyl)-4-(4-methoxy-2-methyl-benzoyl)-1-(2-morpholin-4-ium-4-ylethyl)pyrrolidine-2,3-quinone Formula: C27H33N2O7+ MolecularWeight: 497.56012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)C2C(N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)C2C(N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=C(C=CC(=C4)OC)OC

InChI

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