(phenylmethyl) 4-[3-methoxy-3-oxidanylidene-1-(2-oxidanylidenepiperazin-1-yl)propyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-methoxy-3-oxidanylidene-1-(2-oxidanylidenepiperazin-1-yl)propyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-methoxy-3-oxo-1-(2-oxopiperazin-1-yl)propyl]piperidine-1-carboxylate CAS Name: 4-[3-methoxy-3-oxo-1-(2-oxo-1-piperazinyl)propyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-methoxy-3-oxo-1-(2-oxopiperazin-1-yl)propyl]piperidine-1-carboxylate Traditional Name: 4-[3-keto-1-(2-ketopiperazino)-3-methoxy-propyl]piperidine-1-carboxylic acid benzyl ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1CCN(CC1)C(=O)OCC2=CC=CC=C2)N3CCNCC3=O

Isomeric SMILES

COC(=O)CC(C1CCN(CC1)C(=O)OCC2=CC=CC=C2)N3CCNCC3=O

InChI

InChI=1S/C21H29N3O5/c1-28-20(26)13-18(24-12-9-22-14-19(24)25)17-7-10-23(11-8-17)21(27)29-15-16-5-3-2-4-6-16/h2-6,17-18,22H,7-15H2,1H3