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

Systemtic Name: N-[(E)-1-(4-azidophenyl)-3-(2,2-dimethoxyethylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-2-(4-azidophenyl)-1-(2,2-dimethoxyethylcarbamoyl)vinyl]benzamide CAS Name: N-[(E)-1-(4-azidophenyl)-3-(2,2-dimethoxyethylamino)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-1-(4-azidophenyl)-3-(2,2-dimethoxyethylamino)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(E)-2-(4-azidophenyl)-1-(2,2-dimethoxyethylcarbamoyl)vinyl]benzamide Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N5O4/c1-28-18(29-2)13-22-20(27)17(23-19(26)15-6-4-3-5-7-15)12-14-8-10-16(11-9-14)24-25-21/h3-12,18H,13H2,1-2H3,(H,22,27)(H,23,26)/b17-12+