ethyl 4-[5-[(E)-(6-chloranyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(E)-(6-chloranyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(E)-(6-chloro-2-oxo-indolin-3-ylidene)methyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-(6-chloro-2-oxo-1H-indol-3-ylidene)methyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(E)-(6-chloro-2-oxo-1H-indol-3-ylidene)methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-(6-chloro-2-keto-indolin-3-ylidene)methyl]-2-furyl]benzoic acid ethyl ester Formula: C22H16ClNO4 MolecularWeight: 393.81974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C4=C(C=C(C=C4)Cl)NC3=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C/3\C4=C(C=C(C=C4)Cl)NC3=O

InChI

InChI=1S/C22H16ClNO4/c1-2-27-22(26)14-5-3-13(4-6-14)20-10-8-16(28-20)12-18-17-9-7-15(23)11-19(17)24-21(18)25/h3-12H,2H2,1H3,(H,24,25)/b18-12+