methyl (2R)-2-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)-2-ethyl-1-(phenylmethyl)indol-4-yl]oxypropanoate

Systemtic Name: methyl (2R)-2-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)-2-ethyl-1-(phenylmethyl)indol-4-yl]oxypropanoate Openeye Name: methyl (2R)-2-[1-benzyl-3-(2-chloro-2-oxo-acetyl)-2-ethyl-indol-4-yl]oxypropanoate CAS Name: (2R)-2-[[3-(2-chloro-1,2-dioxoethyl)-2-ethyl-1-(phenylmethyl)-4-indolyl]oxy]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[1-benzyl-3-(2-chloro-2-oxoacetyl)-2-ethylindol-4-yl]oxypropanoate Traditional Name: (2R)-2-[1-benzyl-3-(2-chloro-2-keto-acetyl)-2-ethyl-indol-4-yl]oxypropionic acid methyl ester Formula: C23H22ClNO5 MolecularWeight: 427.87748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OC(C)C(=O)OC)C(=O)C(=O)Cl

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2O[C@H](C)C(=O)OC)C(=O)C(=O)Cl

InChI

InChI=1S/C23H22ClNO5/c1-4-16-20(21(26)22(24)27)19-17(25(16)13-15-9-6-5-7-10-15)11-8-12-18(19)30-14(2)23(28)29-3/h5-12,14H,4,13H2,1-3H3/t14-/m1/s1