tert-butyl N-[[3-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)indol-1-yl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[3-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)indol-1-yl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[3-[3-(2-chloro-2-oxo-acetyl)indol-1-yl]phenyl]methyl]carbamate CAS Name: N-[[3-[3-(2-chloro-1,2-dioxoethyl)-1-indolyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[3-[3-(2-chloro-2-oxoacetyl)indol-1-yl]phenyl]methyl]carbamate Traditional Name: N-[3-[3-(2-chloro-2-keto-acetyl)indol-1-yl]benzyl]carbamic acid tert-butyl ester Formula: C22H21ClN2O4 MolecularWeight: 412.86614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC(=CC=C1)N2C=C(C3=CC=CC=C32)C(=O)C(=O)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC(=CC=C1)N2C=C(C3=CC=CC=C32)C(=O)C(=O)Cl

InChI

InChI=1S/C22H21ClN2O4/c1-22(2,3)29-21(28)24-12-14-7-6-8-15(11-14)25-13-17(19(26)20(23)27)16-9-4-5-10-18(16)25/h4-11,13H,12H2,1-3H3,(H,24,28)