sodium (E)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methanolate

Systemtic Name: sodium (E)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methanolate Openeye Name: sodium (E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-indolin-3-ylidene)-(2-thienyl)methanolate CAS Name: sodium (E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-3-indolylidene)-thiophen-2-ylmethanolate IUPAC Name: sodium (E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxoindol-3-ylidene)-thiophen-2-ylmethanolate Traditional Name: sodium (E)-(1-carbamoyl-6-chloro-5-fluoro-2-keto-indolin-3-ylidene)-(2-thienyl)methanolate Formula: C14H7ClFN2NaO3S MolecularWeight: 360.723153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=C2C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)[O-].[Na+]

Isomeric SMILES

C1=CSC(=C1)/C(=C\2/C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)/[O-].[Na+]

InChI

InChI=1S/C14H8ClFN2O3S.Na/c15-7-5-9-6(4-8(7)16)11(13(20)18(9)14(17)21)12(19)10-2-1-3-22-10;/h1-5,19H,(H2,17,21);/q;+1/p-1/b12-11+;