O4-[(Z)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methyl] O1-methyl butanedioate

Systemtic Name: O4-[(Z)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methyl] O1-methyl butanedioate Openeye Name: O4-[(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-indolin-3-ylidene)-(2-thienyl)methyl] O1-methyl butanedioate CAS Name: butanedioic acid O4-[(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-3-indolylidene)-thiophen-2-ylmethyl] ester O1-methyl ester IUPAC Name: 4-O-[(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxoindol-3-ylidene)-thiophen-2-ylmethyl] 1-O-methyl butanedioate Traditional Name: succinic acid O4-[(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-keto-indolin-3-ylidene)-(2-thienyl)methyl] ester O1-methyl ester Formula: C19H14ClFN2O6S MolecularWeight: 452.840663

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)OC(=C1C2=CC(=C(C=C2N(C1=O)C(=O)N)Cl)F)C3=CC=CS3

Isomeric SMILES

COC(=O)CCC(=O)O/C(=C\1/C2=CC(=C(C=C2N(C1=O)C(=O)N)Cl)F)/C3=CC=CS3

InChI

InChI=1S/C19H14ClFN2O6S/c1-28-14(24)4-5-15(25)29-17(13-3-2-6-30-13)16-9-7-11(21)10(20)8-12(9)23(18(16)26)19(22)27/h2-3,6-8H,4-5H2,1H3,(H2,22,27)/b17-16-