methyl 3-(2-diethylaminoethylcarbamoyl)-5-nitro-4-oxidanyl-benzoate

Systemtic Name: methyl 3-(2-diethylaminoethylcarbamoyl)-5-nitro-4-oxidanyl-benzoate Openeye Name: methyl 3-(2-diethylaminoethylcarbamoyl)-4-hydroxy-5-nitro-benzoate CAS Name: 3-[(2-diethylaminoethylamino)-oxomethyl]-4-hydroxy-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-(2-diethylaminoethylcarbamoyl)-4-hydroxy-5-nitrobenzoate Traditional Name: 3-(2-diethylaminoethylcarbamoyl)-4-hydroxy-5-nitro-benzoic acid methyl ester Formula: C15H21N3O6 MolecularWeight: 339.34374

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C(=CC(=C1)C(=O)OC)[N+](=O)[O-])O

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C(=CC(=C1)C(=O)OC)[N+](=O)[O-])O

InChI

InChI=1S/C15H21N3O6/c1-4-17(5-2)7-6-16-14(20)11-8-10(15(21)24-3)9-12(13(11)19)18(22)23/h8-9,19H,4-7H2,1-3H3,(H,16,20)