[3-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indol-2-yl] N-phenylcarbamate

Systemtic Name: [3-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indol-2-yl] N-phenylcarbamate Openeye Name: [3-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indol-2-yl] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [3-[(3,3-dimethyl-1-oxobutyl)amino]-1-[(2-fluorophenyl)methyl]-2-indolyl] ester IUPAC Name: [3-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indol-2-yl] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [3-(3,3-dimethylbutanoylamino)-1-(2-fluorobenzyl)indol-2-yl] ester Formula: C28H28FN3O3 MolecularWeight: 473.538623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3F)OC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)CC(=O)NC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3F)OC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H28FN3O3/c1-28(2,3)17-24(33)31-25-21-14-8-10-16-23(21)32(18-19-11-7-9-15-22(19)29)26(25)35-27(34)30-20-12-5-4-6-13-20/h4-16H,17-18H2,1-3H3,(H,30,34)(H,31,33)