3-[(2R)-2-(3-bromophenyl)-3-[(4-methylphenyl)-oxidanyl-methylidene]-4,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[(2R)-2-(3-bromophenyl)-3-[(4-methylphenyl)-oxidanyl-methylidene]-4,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[(2R)-2-(3-bromophenyl)-3-[hydroxy(p-tolyl)methylene]-4,5-dioxo-pyrrolidin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[(2R)-2-(3-bromophenyl)-3-[hydroxy-(4-methylphenyl)methylidene]-4,5-dioxo-1-pyrrolidinyl]propyl-dimethylammonium IUPAC Name: 3-[(2R)-2-(3-bromophenyl)-3-[hydroxy-(4-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]propyl-dimethylazanium Traditional Name: 3-[(2R)-2-(3-bromophenyl)-3-[hydroxy(p-tolyl)methylene]-4,5-diketo-pyrrolidino]propyl-dimethyl-ammonium Formula: C23H26BrN2O3+ MolecularWeight: 458.36814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC[NH+](C)C)C3=CC(=CC=C3)Br)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=C2[C@H](N(C(=O)C2=O)CCC[NH+](C)C)C3=CC(=CC=C3)Br)O

InChI

InChI=1S/C23H25BrN2O3/c1-15-8-10-16(11-9-15)21(27)19-20(17-6-4-7-18(24)14-17)26(23(29)22(19)28)13-5-12-25(2)3/h4,6-11,14,20,27H,5,12-13H2,1-3H3/p+1/t20-/m1/s1