N-[2-(3-ethoxypropylcarbamoyl)phenyl]-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-[2-(3-ethoxypropylcarbamoyl)phenyl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[2-(3-ethoxypropylcarbamoyl)phenyl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[2-[(3-ethoxypropylamino)-oxomethyl]phenyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[2-(3-ethoxypropylcarbamoyl)phenyl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[2-(3-ethoxypropylcarbamoyl)phenyl]-4,5-dimethoxy-2-nitro-benzamide Formula: C21H25N3O7 MolecularWeight: 431.4391

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CCOCCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C21H25N3O7/c1-4-31-11-7-10-22-20(25)14-8-5-6-9-16(14)23-21(26)15-12-18(29-2)19(30-3)13-17(15)24(27)28/h5-6,8-9,12-13H,4,7,10-11H2,1-3H3,(H,22,25)(H,23,26)