2-[4-(2,5-dimethylphenyl)carbonyl-2,3-bis(oxidanylidene)-5-thiophen-2-yl-pyrrolidin-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[4-(2,5-dimethylphenyl)carbonyl-2,3-bis(oxidanylidene)-5-thiophen-2-yl-pyrrolidin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[4-(2,5-dimethylbenzoyl)-2,3-dioxo-5-(2-thienyl)pyrrolidin-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[4-[(2,5-dimethylphenyl)-oxomethyl]-2,3-dioxo-5-thiophen-2-yl-1-pyrrolidinyl]ethyl-dimethylammonium IUPAC Name: 2-[4-(2,5-dimethylbenzoyl)-2,3-dioxo-5-thiophen-2-ylpyrrolidin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[4-(2,5-dimethylbenzoyl)-2,3-diketo-5-(2-thienyl)pyrrolidino]ethyl-dimethyl-ammonium Formula: C21H25N2O3S+ MolecularWeight: 385.4998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C2C(N(C(=O)C2=O)CC[NH+](C)C)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)C2C(N(C(=O)C2=O)CC[NH+](C)C)C3=CC=CS3

InChI

InChI=1S/C21H24N2O3S/c1-13-7-8-14(2)15(12-13)19(24)17-18(16-6-5-11-27-16)23(10-9-22(3)4)21(26)20(17)25/h5-8,11-12,17-18H,9-10H2,1-4H3/p+1