[(Z)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methyl] 3-methoxybenzoate

Systemtic Name: [(Z)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methyl] 3-methoxybenzoate Openeye Name: [(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-indolin-3-ylidene)-(2-thienyl)methyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-3-indolylidene)-thiophen-2-ylmethyl] ester IUPAC Name: [(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxoindol-3-ylidene)-thiophen-2-ylmethyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-keto-indolin-3-ylidene)-(2-thienyl)methyl] ester Formula: C22H14ClFN2O5S MolecularWeight: 472.873363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)OC(=C2C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)O/C(=C\2/C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)/C4=CC=CS4

InChI

InChI=1S/C22H14ClFN2O5S/c1-30-12-5-2-4-11(8-12)21(28)31-19(17-6-3-7-32-17)18-13-9-15(24)14(23)10-16(13)26(20(18)27)22(25)29/h2-10H,1H3,(H2,25,29)/b19-18-