(phenylmethyl) 3-(3-chloranyl-2-oxidanylidene-propyl)-2-methyl-indole-1-carboxylate

Systemtic Name: (phenylmethyl) 3-(3-chloranyl-2-oxidanylidene-propyl)-2-methyl-indole-1-carboxylate Openeye Name: benzyl 3-(3-chloro-2-oxo-propyl)-2-methyl-indole-1-carboxylate CAS Name: 3-(3-chloro-2-oxopropyl)-2-methyl-1-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(3-chloro-2-oxopropyl)-2-methylindole-1-carboxylate Traditional Name: 3-(3-chloro-2-keto-propyl)-2-methyl-indole-1-carboxylic acid benzyl ester Formula: C20H18ClNO3 MolecularWeight: 355.81482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C(=O)OCC3=CC=CC=C3)CC(=O)CCl

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C(=O)OCC3=CC=CC=C3)CC(=O)CCl

InChI

InChI=1S/C20H18ClNO3/c1-14-18(11-16(23)12-21)17-9-5-6-10-19(17)22(14)20(24)25-13-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3