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

Systemtic Name: sodium (E)-(1-aminocarbonyl-5-chloranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methanolate Openeye Name: sodium (E)-(1-carbamoyl-5-chloro-2-oxo-indolin-3-ylidene)-(2-thienyl)methanolate CAS Name: sodium (E)-(1-carbamoyl-5-chloro-2-oxo-3-indolylidene)-thiophen-2-ylmethanolate IUPAC Name: sodium (E)-(1-carbamoyl-5-chloro-2-oxoindol-3-ylidene)-thiophen-2-ylmethanolate Traditional Name: sodium (E)-(1-carbamoyl-5-chloro-2-keto-indolin-3-ylidene)-(2-thienyl)methanolate Formula: C14H8ClN2NaO3S MolecularWeight: 342.73269

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=C2C3=C(C=CC(=C3)Cl)N(C2=O)C(=O)N)[O-].[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C14H9ClN2O3S.Na/c15-7-3-4-9-8(6-7)11(13(19)17(9)14(16)20)12(18)10-2-1-5-21-10;/h1-6,18H,(H2,16,20);/q;+1/p-1/b12-11+;