(phenylmethyl) 2-[1-[2-(2-nitrophenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[1-[2-(2-nitrophenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: benzyl 2-[1-[2-(2-nitrophenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2-nitrophenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[1-[2-(2-nitrophenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(2-nitrophenoxy)propanoyl]piperazin-2-yl]acetic acid benzyl ester Formula: C22H23N3O7 MolecularWeight: 441.43392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNC(=O)C1CC(=O)OCC2=CC=CC=C2)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCNC(=O)C1CC(=O)OCC2=CC=CC=C2)OC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O7/c1-15(32-19-10-6-5-9-17(19)25(29)30)22(28)24-12-11-23-21(27)18(24)13-20(26)31-14-16-7-3-2-4-8-16/h2-10,15,18H,11-14H2,1H3,(H,23,27)