[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 2-(heptanoylamino)ethanoate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 2-(heptanoylamino)ethanoate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] 2-(heptanoylamino)acetate CAS Name: 2-(1-oxoheptylamino)acetic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] 2-(heptanoylamino)acetate Traditional Name: 2-(enanthylamino)acetic acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NCC(=O)OCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC(=O)NCC(=O)OCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C17H22N2O6/c1-2-3-4-5-6-16(21)18-11-17(22)25-12-15(20)13-7-9-14(10-8-13)19(23)24/h7-10H,2-6,11-12H2,1H3,(H,18,21)