1-(azepan-1-yl)-2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]ethanone Formula: C25H27ClN2O3 MolecularWeight: 438.94648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)N4CCCCCC4

InChI

InChI=1S/C25H27ClN2O3/c1-17-21(16-24(29)27-13-5-3-4-6-14-27)22-15-20(31-2)11-12-23(22)28(17)25(30)18-7-9-19(26)10-8-18/h7-12,15H,3-6,13-14,16H2,1-2H3