3-phenylpropyl 2-[3-oxidanylidene-1-(4-phenylmethoxyphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: 3-phenylpropyl 2-[3-oxidanylidene-1-(4-phenylmethoxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: 3-phenylpropyl 2-[1-(4-benzyloxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-(4-phenylmethoxyphenyl)methyl]-2-piperazinyl]acetic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 2-[3-oxo-1-(4-phenylmethoxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[1-(4-benzoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid 3-phenylpropyl ester Formula: C29H30N2O5 MolecularWeight: 486.5589

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)OCCCC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)OCCCC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C29H30N2O5/c32-27(35-19-7-12-22-8-3-1-4-9-22)20-26-28(33)30-17-18-31(26)29(34)24-13-15-25(16-14-24)36-21-23-10-5-2-6-11-23/h1-6,8-11,13-16,26H,7,12,17-21H2,(H,30,33)