4-nitro-N-[3-oxidanylidene-3-[(3,4,5-trimethoxyphenyl)amino]propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-[(3,4,5-trimethoxyphenyl)amino]propyl]benzamide Openeye Name: 4-nitro-N-[3-oxo-3-(3,4,5-trimethoxyanilino)propyl]benzamide CAS Name: 4-nitro-N-[3-oxo-3-(3,4,5-trimethoxyanilino)propyl]benzamide IUPAC Name: 4-nitro-N-[3-oxo-3-(3,4,5-trimethoxyanilino)propyl]benzamide Traditional Name: N-[3-keto-3-(3,4,5-trimethoxyanilino)propyl]-4-nitro-benzamide Formula: C19H21N3O7 MolecularWeight: 403.38594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O7/c1-27-15-10-13(11-16(28-2)18(15)29-3)21-17(23)8-9-20-19(24)12-4-6-14(7-5-12)22(25)26/h4-7,10-11H,8-9H2,1-3H3,(H,20,24)(H,21,23)