tert-butyl 2-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)-1-(phenylmethyl)indol-4-yl]oxyethanoate

Systemtic Name: tert-butyl 2-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)-1-(phenylmethyl)indol-4-yl]oxyethanoate Openeye Name: tert-butyl 2-[1-benzyl-3-(2-chloro-2-oxo-acetyl)indol-4-yl]oxyacetate CAS Name: 2-[[3-(2-chloro-1,2-dioxoethyl)-1-(phenylmethyl)-4-indolyl]oxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-benzyl-3-(2-chloro-2-oxoacetyl)indol-4-yl]oxyacetate Traditional Name: 2-[1-benzyl-3-(2-chloro-2-keto-acetyl)indol-4-yl]oxyacetic acid tert-butyl ester Formula: C23H22ClNO5 MolecularWeight: 427.87748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC=CC2=C1C(=CN2CC3=CC=CC=C3)C(=O)C(=O)Cl

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC=CC2=C1C(=CN2CC3=CC=CC=C3)C(=O)C(=O)Cl

InChI

InChI=1S/C23H22ClNO5/c1-23(2,3)30-19(26)14-29-18-11-7-10-17-20(18)16(21(27)22(24)28)13-25(17)12-15-8-5-4-6-9-15/h4-11,13H,12,14H2,1-3H3