N-[(E)-1-(4-azidophenyl)-3-(4,4-dimethoxybutylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-1-(4-azidophenyl)-3-(4,4-dimethoxybutylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-2-(4-azidophenyl)-1-(4,4-dimethoxybutylcarbamoyl)vinyl]benzamide CAS Name: N-[(E)-1-(4-azidophenyl)-3-(4,4-dimethoxybutylamino)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-1-(4-azidophenyl)-3-(4,4-dimethoxybutylamino)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(E)-2-(4-azidophenyl)-1-(4,4-dimethoxybutylcarbamoyl)vinyl]benzamide Formula: C22H25N5O4 MolecularWeight: 423.465

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(CCCNC(=O)C(=CC1=CC=C(C=C1)N=[N+]=[N-])NC(=O)C2=CC=CC=C2)OC

Isomeric SMILES

COC(CCCNC(=O)/C(=C\C1=CC=C(C=C1)N=[N+]=[N-])/NC(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C22H25N5O4/c1-30-20(31-2)9-6-14-24-22(29)19(25-21(28)17-7-4-3-5-8-17)15-16-10-12-18(13-11-16)26-27-23/h3-5,7-8,10-13,15,20H,6,9,14H2,1-2H3,(H,24,29)(H,25,28)/b19-15+