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

Systemtic Name: 4-ethoxy-N-[4-(2-methylpropanoylamino)phenyl]-3-nitro-benzamide Openeye Name: 4-ethoxy-N-[4-(2-methylpropanoylamino)phenyl]-3-nitro-benzamide CAS Name: 4-ethoxy-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-3-nitrobenzamide IUPAC Name: 4-ethoxy-N-[4-(2-methylpropanoylamino)phenyl]-3-nitrobenzamide Traditional Name: 4-ethoxy-N-[4-(isobutyrylamino)phenyl]-3-nitro-benzamide Formula: C19H21N3O5 MolecularWeight: 371.38714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O5/c1-4-27-17-10-5-13(11-16(17)22(25)26)19(24)21-15-8-6-14(7-9-15)20-18(23)12(2)3/h5-12H,4H2,1-3H3,(H,20,23)(H,21,24)