[4-[2-(4-cyanophenoxy)ethanoylamino]-3-nitro-phenyl] butaneperoxoate

Systemtic Name: [4-[2-(4-cyanophenoxy)ethanoylamino]-3-nitro-phenyl] butaneperoxoate Openeye Name: [4-[[2-(4-cyanophenoxy)acetyl]amino]-3-nitro-phenyl] butaneperoxoate CAS Name: butaneperoxoic acid [4-[[2-(4-cyanophenoxy)-1-oxoethyl]amino]-3-nitrophenyl] ester IUPAC Name: [4-[[2-(4-cyanophenoxy)acetyl]amino]-3-nitrophenyl] butaneperoxoate Traditional Name: peroxybutyric acid [4-[[2-(4-cyanophenoxy)acetyl]amino]-3-nitro-phenyl] ester Formula: C19H17N3O7 MolecularWeight: 399.35418

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OOC1=CC(=C(C=C1)NC(=O)COC2=CC=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)OOC1=CC(=C(C=C1)NC(=O)COC2=CC=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O7/c1-2-3-19(24)29-28-15-8-9-16(17(10-15)22(25)26)21-18(23)12-27-14-6-4-13(11-20)5-7-14/h4-10H,2-3,12H2,1H3,(H,21,23)