tert-butyl N-[(3E)-3-(5-chloranyl-2-oxidanylidene-1H-indol-3-ylidene)-1H-2-benzofuran-5-yl]carbamate

Systemtic Name: tert-butyl N-[(3E)-3-(5-chloranyl-2-oxidanylidene-1H-indol-3-ylidene)-1H-2-benzofuran-5-yl]carbamate Openeye Name: tert-butyl N-[(3E)-3-(5-chloro-2-oxo-indolin-3-ylidene)-1H-isobenzofuran-5-yl]carbamate CAS Name: N-[(3E)-3-(5-chloro-2-oxo-1H-indol-3-ylidene)-1H-isobenzofuran-5-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3E)-3-(5-chloro-2-oxo-1H-indol-3-ylidene)-1H-2-benzofuran-5-yl]carbamate Traditional Name: N-[(3E)-3-(5-chloro-2-keto-indolin-3-ylidene)phthalan-5-yl]carbamic acid tert-butyl ester Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC2=C(COC2=C3C4=C(C=CC(=C4)Cl)NC3=O)C=C1

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC\2=C(CO/C2=C/3\C4=C(C=CC(=C4)Cl)NC3=O)C=C1

InChI

InChI=1S/C21H19ClN2O4/c1-21(2,3)28-20(26)23-13-6-4-11-10-27-18(14(11)9-13)17-15-8-12(22)5-7-16(15)24-19(17)25/h4-9H,10H2,1-3H3,(H,23,26)(H,24,25)/b18-17+