3-[2-(2-ethoxyphenyl)-3-(4-methoxy-3-methyl-phenyl)carbonyl-4,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[2-(2-ethoxyphenyl)-3-(4-methoxy-3-methyl-phenyl)carbonyl-4,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[2-(2-ethoxyphenyl)-3-(4-methoxy-3-methyl-benzoyl)-4,5-dioxo-pyrrolidin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-(2-ethoxyphenyl)-3-[(4-methoxy-3-methylphenyl)-oxomethyl]-4,5-dioxo-1-pyrrolidinyl]propyl-dimethylammonium IUPAC Name: 3-[2-(2-ethoxyphenyl)-3-(4-methoxy-3-methylbenzoyl)-4,5-dioxopyrrolidin-1-yl]propyl-dimethylazanium Traditional Name: 3-[2,3-diketo-4-(4-methoxy-3-methyl-benzoyl)-5-o-phenetyl-pyrrolidino]propyl-dimethyl-ammonium Formula: C26H33N2O5+ MolecularWeight: 453.55062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2C(C(=O)C(=O)N2CCC[NH+](C)C)C(=O)C3=CC(=C(C=C3)OC)C

Isomeric SMILES

CCOC1=CC=CC=C1C2C(C(=O)C(=O)N2CCC[NH+](C)C)C(=O)C3=CC(=C(C=C3)OC)C

InChI

InChI=1S/C26H32N2O5/c1-6-33-21-11-8-7-10-19(21)23-22(24(29)18-12-13-20(32-5)17(2)16-18)25(30)26(31)28(23)15-9-14-27(3)4/h7-8,10-13,16,22-23H,6,9,14-15H2,1-5H3/p+1