O3-acetamido O1-[3-(2-methoxy-5-nitro-phenyl)pentan-3-yl] propanedioate

Systemtic Name: O3-acetamido O1-[3-(2-methoxy-5-nitro-phenyl)pentan-3-yl] propanedioate Openeye Name: O3-acetamido O1-[1-ethyl-1-(2-methoxy-5-nitro-phenyl)propyl] propanedioate CAS Name: propanedioic acid O3-acetamido ester O1-[3-(2-methoxy-5-nitrophenyl)pentan-3-yl] ester IUPAC Name: 3-O-acetamido 1-O-[3-(2-methoxy-5-nitrophenyl)pentan-3-yl] propanedioate Traditional Name: malonic acid O3-acetamido ester O1-[1-ethyl-1-(2-methoxy-5-nitro-phenyl)propyl] ester Formula: C17H22N2O8 MolecularWeight: 382.36518

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=C(C=CC(=C1)[N+](=O)[O-])OC)OC(=O)CC(=O)ONC(=O)C

Isomeric SMILES

CCC(CC)(C1=C(C=CC(=C1)[N+](=O)[O-])OC)OC(=O)CC(=O)ONC(=O)C

InChI

InChI=1S/C17H22N2O8/c1-5-17(6-2,26-15(21)10-16(22)27-18-11(3)20)13-9-12(19(23)24)7-8-14(13)25-4/h7-9H,5-6,10H2,1-4H3,(H,18,20)