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

Systemtic Name: butan-2-yl 2-[1-[2-(4-nitrophenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: sec-butyl 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 butan-2-yl ester IUPAC Name: butan-2-yl 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 sec-butyl ester Formula: C19H25N3O7 MolecularWeight: 407.4177

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CC1C(=O)NCCN1C(=O)C(C)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)OC(=O)CC1C(=O)NCCN1C(=O)C(C)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O7/c1-4-12(2)28-17(23)11-16-18(24)20-9-10-21(16)19(25)13(3)29-15-7-5-14(6-8-15)22(26)27/h5-8,12-13,16H,4,9-11H2,1-3H3,(H,20,24)