3-[[5-chloranyl-2-oxidanyl-3-[(Z)-(3-oxidanylidenethiophen-2-ylidene)methyl]indol-1-yl]carbonylamino]propyl-trimethyl-azanium

Systemtic Name: 3-[[5-chloranyl-2-oxidanyl-3-[(Z)-(3-oxidanylidenethiophen-2-ylidene)methyl]indol-1-yl]carbonylamino]propyl-trimethyl-azanium Openeye Name: 3-[[5-chloro-2-hydroxy-3-[(Z)-(3-oxo-2-thienylidene)methyl]indole-1-carbonyl]amino]propyl-trimethyl-ammonium CAS Name: 3-[[[5-chloro-2-hydroxy-3-[(Z)-(3-oxo-2-thiophenylidene)methyl]-1-indolyl]-oxomethyl]amino]propyl-trimethylammonium IUPAC Name: 3-[[5-chloro-2-hydroxy-3-[(Z)-(3-oxothiophen-2-ylidene)methyl]indole-1-carbonyl]amino]propyl-trimethylazanium Traditional Name: 3-[[5-chloro-2-hydroxy-3-[(Z)-(3-keto-2-thienylidene)methyl]indole-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(=C1O)C=C3C(=O)C=CS3

Isomeric SMILES

C[N+](C)(C)CCCNC(=O)N1C2=C(C=C(C=C2)Cl)C(=C1O)/C=C\3/C(=O)C=CS3

InChI

InChI=1S/C20H22ClN3O3S/c1-24(2,3)9-4-8-22-20(27)23-16-6-5-13(21)11-14(16)15(19(23)26)12-18-17(25)7-10-28-18/h5-7,10-12H,4,8-9H2,1-3H3,(H-,22,25,26,27)/p+1