N-[2-(cyclopropylmethylcarbamoyl)phenyl]-2,6-dimethoxy-3-nitro-benzamide

Systemtic Name: N-[2-(cyclopropylmethylcarbamoyl)phenyl]-2,6-dimethoxy-3-nitro-benzamide Openeye Name: N-[2-(cyclopropylmethylcarbamoyl)phenyl]-2,6-dimethoxy-3-nitro-benzamide CAS Name: N-[2-[(cyclopropylmethylamino)-oxomethyl]phenyl]-2,6-dimethoxy-3-nitrobenzamide IUPAC Name: N-[2-(cyclopropylmethylcarbamoyl)phenyl]-2,6-dimethoxy-3-nitrobenzamide Traditional Name: N-[2-(cyclopropylmethylcarbamoyl)phenyl]-2,6-dimethoxy-3-nitro-benzamide Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)NC2=CC=CC=C2C(=O)NCC3CC3

Isomeric SMILES

COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)NC2=CC=CC=C2C(=O)NCC3CC3

InChI

InChI=1S/C20H21N3O6/c1-28-16-10-9-15(23(26)27)18(29-2)17(16)20(25)22-14-6-4-3-5-13(14)19(24)21-11-12-7-8-12/h3-6,9-10,12H,7-8,11H2,1-2H3,(H,21,24)(H,22,25)