5-ethoxy-4-methoxy-N-[3-(2-methylpropanoylamino)phenyl]-2-nitro-benzamide

Systemtic Name: 5-ethoxy-4-methoxy-N-[3-(2-methylpropanoylamino)phenyl]-2-nitro-benzamide Openeye Name: 5-ethoxy-4-methoxy-N-[3-(2-methylpropanoylamino)phenyl]-2-nitro-benzamide CAS Name: 5-ethoxy-4-methoxy-N-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-2-nitrobenzamide IUPAC Name: 5-ethoxy-4-methoxy-N-[3-(2-methylpropanoylamino)phenyl]-2-nitrobenzamide Traditional Name: 5-ethoxy-N-[3-(isobutyrylamino)phenyl]-4-methoxy-2-nitro-benzamide Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C(C)C)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C(C)C)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23N3O6/c1-5-29-18-10-15(16(23(26)27)11-17(18)28-4)20(25)22-14-8-6-7-13(9-14)21-19(24)12(2)3/h6-12H,5H2,1-4H3,(H,21,24)(H,22,25)