6-chloranyl-N-(3-ethoxypropylcarbamoyl)-2-nitro-3,4-bis(oxidanyl)benzamide

Systemtic Name: 6-chloranyl-N-(3-ethoxypropylcarbamoyl)-2-nitro-3,4-bis(oxidanyl)benzamide Openeye Name: 6-chloro-N-(3-ethoxypropylcarbamoyl)-3,4-dihydroxy-2-nitro-benzamide CAS Name: 6-chloro-N-[(3-ethoxypropylamino)-oxomethyl]-3,4-dihydroxy-2-nitrobenzamide IUPAC Name: 6-chloro-N-(3-ethoxypropylcarbamoyl)-3,4-dihydroxy-2-nitrobenzamide Traditional Name: 6-chloro-N-(3-ethoxypropylcarbamoyl)-3,4-dihydroxy-2-nitro-benzamide Formula: C13H16ClN3O7 MolecularWeight: 361.73504

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)NC(=O)C1=C(C=C(C(=C1[N+](=O)[O-])O)O)Cl

Isomeric SMILES

CCOCCCNC(=O)NC(=O)C1=C(C=C(C(=C1[N+](=O)[O-])O)O)Cl

InChI

InChI=1S/C13H16ClN3O7/c1-2-24-5-3-4-15-13(21)16-12(20)9-7(14)6-8(18)11(19)10(9)17(22)23/h6,18-19H,2-5H2,1H3,(H2,15,16,20,21)