[2-[2-(azepan-1-yl)ethoxy]-1-phenyl-ethyl] benzoate

Systemtic Name: [2-[2-(azepan-1-yl)ethoxy]-1-phenyl-ethyl] benzoate Openeye Name: [2-[2-(azepan-1-yl)ethoxy]-1-phenyl-ethyl] benzoate CAS Name: benzoic acid [2-[2-(1-azepanyl)ethoxy]-1-phenylethyl] ester IUPAC Name: [2-[2-(azepan-1-yl)ethoxy]-1-phenylethyl] benzoate Traditional Name: benzoic acid [2-[2-(azepan-1-yl)ethoxy]-1-phenyl-ethyl] ester Formula: C23H29NO3 MolecularWeight: 367.48126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOCC(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)CCOCC(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H29NO3/c25-23(21-13-7-4-8-14-21)27-22(20-11-5-3-6-12-20)19-26-18-17-24-15-9-1-2-10-16-24/h3-8,11-14,22H,1-2,9-10,15-19H2