ethyl 3-(3-butoxypropylcarbamoyl)-5-nitro-benzoate

Systemtic Name: ethyl 3-(3-butoxypropylcarbamoyl)-5-nitro-benzoate Openeye Name: ethyl 3-(3-butoxypropylcarbamoyl)-5-nitro-benzoate CAS Name: 3-[(3-butoxypropylamino)-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-(3-butoxypropylcarbamoyl)-5-nitrobenzoate Traditional Name: 3-(3-butoxypropylcarbamoyl)-5-nitro-benzoic acid ethyl ester Formula: C17H24N2O6 MolecularWeight: 352.38226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O6/c1-3-5-8-24-9-6-7-18-16(20)13-10-14(17(21)25-4-2)12-15(11-13)19(22)23/h10-12H,3-9H2,1-2H3,(H,18,20)