[2-methyl-3-[(1-phenethylpiperidin-4-yl)carbamoyl]-1-(phenylmethyl)indol-5-yl] 2,2-dimethylpropanoate

Systemtic Name: [2-methyl-3-[(1-phenethylpiperidin-4-yl)carbamoyl]-1-(phenylmethyl)indol-5-yl] 2,2-dimethylpropanoate Openeye Name: [1-benzyl-2-methyl-3-[(1-phenethyl-4-piperidyl)carbamoyl]indol-5-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-methyl-3-[oxo-[(1-phenethyl-4-piperidinyl)amino]methyl]-1-(phenylmethyl)-5-indolyl] ester IUPAC Name: [1-benzyl-2-methyl-3-[(1-phenethylpiperidin-4-yl)carbamoyl]indol-5-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [1-benzyl-2-methyl-3-[(1-phenethyl-4-piperidyl)carbamoyl]indol-5-yl] ester Formula: C35H41N3O3 MolecularWeight: 551.71834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC(=O)C(C)(C)C)C(=O)NC4CCN(CC4)CCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC(=O)C(C)(C)C)C(=O)NC4CCN(CC4)CCC5=CC=CC=C5

InChI

InChI=1S/C35H41N3O3/c1-25-32(33(39)36-28-18-21-37(22-19-28)20-17-26-11-7-5-8-12-26)30-23-29(41-34(40)35(2,3)4)15-16-31(30)38(25)24-27-13-9-6-10-14-27/h5-16,23,28H,17-22,24H2,1-4H3,(H,36,39)