[2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium

Systemtic Name: [2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium Openeye Name: [2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxo-ethyl]-methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium CAS Name: [2-[(2R)-2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-2-oxoethyl]-methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium IUPAC Name: [2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]-methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium Traditional Name: [2-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidino]-2-keto-ethyl]-(2-keto-2-mesidino-ethyl)-methyl-ammonium Formula: C26H36N3O4+ MolecularWeight: 454.58174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](C)CC(=O)N2CCCC2C3=C(C=CC(=C3)OC)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](C)CC(=O)N2CCC[C@@H]2C3=C(C=CC(=C3)OC)OC)C

InChI

InChI=1S/C26H35N3O4/c1-17-12-18(2)26(19(3)13-17)27-24(30)15-28(4)16-25(31)29-11-7-8-22(29)21-14-20(32-5)9-10-23(21)33-6/h9-10,12-14,22H,7-8,11,15-16H2,1-6H3,(H,27,30)/p+1/t22-/m1/s1