(phenylmethyl) 2-[3-oxidanylidene-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-oxidanylidene-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]ethanoate Openeye Name: benzyl 2-[3-oxo-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[1-oxo-2-(4-phenylphenoxy)butyl]-2-piperazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-oxo-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]acetic acid benzyl ester Formula: C29H30N2O5 MolecularWeight: 486.5589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCNC(=O)C1CC(=O)OCC2=CC=CC=C2)OC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)N1CCNC(=O)C1CC(=O)OCC2=CC=CC=C2)OC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H30N2O5/c1-2-26(36-24-15-13-23(14-16-24)22-11-7-4-8-12-22)29(34)31-18-17-30-28(33)25(31)19-27(32)35-20-21-9-5-3-6-10-21/h3-16,25-26H,2,17-20H2,1H3,(H,30,33)