[(E)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methoxy]methyl 2-phenylmethoxypentanoate

Systemtic Name: [(E)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methoxy]methyl 2-phenylmethoxypentanoate Openeye Name: [(E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-indolin-3-ylidene)-(2-thienyl)methoxy]methyl 2-benzyloxypentanoate CAS Name: 2-phenylmethoxypentanoic acid [(E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-3-indolylidene)-thiophen-2-ylmethoxy]methyl ester IUPAC Name: [(E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxoindol-3-ylidene)-thiophen-2-ylmethoxy]methyl 2-phenylmethoxypentanoate Traditional Name: 2-benzoxyvaleric acid [(E)-(1-carbamoyl-6-chloro-5-fluoro-2-keto-indolin-3-ylidene)-(2-thienyl)methoxy]methyl ester Formula: C27H24ClFN2O6S MolecularWeight: 559.005663

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OCOC(=C1C2=CC(=C(C=C2N(C1=O)C(=O)N)Cl)F)C3=CC=CS3)OCC4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)OCO/C(=C/1\C2=CC(=C(C=C2N(C1=O)C(=O)N)Cl)F)/C3=CC=CS3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H24ClFN2O6S/c1-2-7-21(35-14-16-8-4-3-5-9-16)26(33)37-15-36-24(22-10-6-11-38-22)23-17-12-19(29)18(28)13-20(17)31(25(23)32)27(30)34/h3-6,8-13,21H,2,7,14-15H2,1H3,(H2,30,34)/b24-23+