phenethyl 2-[1-[2-(4-nitrophenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: phenethyl 2-[1-[2-(4-nitrophenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: phenethyl 2-[1-[2-(4-nitrophenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(4-nitrophenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid phenethyl ester IUPAC Name: phenethyl 2-[1-[2-(4-nitrophenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(4-nitrophenoxy)propanoyl]piperazin-2-yl]acetic acid phenethyl ester Formula: C23H25N3O7 MolecularWeight: 455.4605

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNC(=O)C1CC(=O)OCCC2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCNC(=O)C1CC(=O)OCCC2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O7/c1-16(33-19-9-7-18(8-10-19)26(30)31)23(29)25-13-12-24-22(28)20(25)15-21(27)32-14-11-17-5-3-2-4-6-17/h2-10,16,20H,11-15H2,1H3,(H,24,28)