[3-[4-[(phenylmethyl)amino]butanoyl]phenyl] 2,2-dimethylpropanoate

Systemtic Name: [3-[4-[(phenylmethyl)amino]butanoyl]phenyl] 2,2-dimethylpropanoate Openeye Name: [3-[4-(benzylamino)butanoyl]phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-[1-oxo-4-[(phenylmethyl)amino]butyl]phenyl] ester IUPAC Name: [3-[4-(benzylamino)butanoyl]phenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [3-[4-(benzylamino)butanoyl]phenyl] ester Formula: C22H27NO3 MolecularWeight: 353.45468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC=CC(=C1)C(=O)CCCNCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC=CC(=C1)C(=O)CCCNCC2=CC=CC=C2

InChI

InChI=1S/C22H27NO3/c1-22(2,3)21(25)26-19-12-7-11-18(15-19)20(24)13-8-14-23-16-17-9-5-4-6-10-17/h4-7,9-12,15,23H,8,13-14,16H2,1-3H3