3-[(5-chloranyl-2-oxidanylidene-3-thiophen-2-ylcarbonyl-3H-indol-1-yl)carbonylamino]propyl-trimethyl-azanium

Systemtic Name: 3-[(5-chloranyl-2-oxidanylidene-3-thiophen-2-ylcarbonyl-3H-indol-1-yl)carbonylamino]propyl-trimethyl-azanium Openeye Name: 3-[[5-chloro-2-oxo-3-(thiophene-2-carbonyl)indoline-1-carbonyl]amino]propyl-trimethyl-ammonium CAS Name: 3-[[[5-chloro-2-oxo-3-[oxo(thiophen-2-yl)methyl]-3H-indol-1-yl]-oxomethyl]amino]propyl-trimethylammonium IUPAC Name: 3-[[5-chloro-2-oxo-3-(thiophene-2-carbonyl)-3H-indole-1-carbonyl]amino]propyl-trimethylazanium Traditional Name: 3-[[5-chloro-2-keto-3-(2-thenoyl)indoline-1-carbonyl]amino]propyl-trimethyl-ammonium Formula: C20H23ClN3O3S+ MolecularWeight: 420.93292

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCNC(=O)N1C2=C(C=C(C=C2)Cl)C(C1=O)C(=O)C3=CC=CS3

Isomeric SMILES

C[N+](C)(C)CCCNC(=O)N1C2=C(C=C(C=C2)Cl)C(C1=O)C(=O)C3=CC=CS3

InChI

InChI=1S/C20H22ClN3O3S/c1-24(2,3)10-5-9-22-20(27)23-15-8-7-13(21)12-14(15)17(19(23)26)18(25)16-6-4-11-28-16/h4,6-8,11-12,17H,5,9-10H2,1-3H3/p+1