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

Systemtic Name: 4-(4-methoxy-2-methyl-phenyl)carbonyl-5-(2-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Openeye Name: 4-(4-methoxy-2-methyl-benzoyl)-5-(2-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione CAS Name: 4-[(4-methoxy-2-methylphenyl)-oxomethyl]-5-(2-methoxyphenyl)-1-[3-(4-morpholin-4-iumyl)propyl]pyrrolidine-2,3-dione IUPAC Name: 4-(4-methoxy-2-methylbenzoyl)-5-(2-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Traditional Name: 4-(4-methoxy-2-methyl-benzoyl)-5-(2-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-quinone Formula: C27H33N2O6+ MolecularWeight: 481.56072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)C2C(N(C(=O)C2=O)CCC[NH+]3CCOCC3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)C2C(N(C(=O)C2=O)CCC[NH+]3CCOCC3)C4=CC=CC=C4OC

InChI

InChI=1S/C27H32N2O6/c1-18-17-19(33-2)9-10-20(18)25(30)23-24(21-7-4-5-8-22(21)34-3)29(27(32)26(23)31)12-6-11-28-13-15-35-16-14-28/h4-5,7-10,17,23-24H,6,11-16H2,1-3H3/p+1