N-(2H-benzotriazol-5-yl)-3-(prop-2-enoylamino)propanamide

Systemtic Name: N-(2H-benzotriazol-5-yl)-3-(prop-2-enoylamino)propanamide Openeye Name: N-(2H-benzotriazol-5-yl)-3-(prop-2-enoylamino)propanamide CAS Name: N-(2H-benzotriazol-5-yl)-3-(1-oxoprop-2-enylamino)propanamide IUPAC Name: N-(2H-benzotriazol-5-yl)-3-(prop-2-enoylamino)propanamide Traditional Name: 3-acrylamido-N-(2H-benzotriazol-5-yl)propionamide Formula: C12H13N5O2 MolecularWeight: 259.26392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCCC(=O)NC1=CC2=NNN=C2C=C1

Isomeric SMILES

C=CC(=O)NCCC(=O)NC1=CC2=NNN=C2C=C1

InChI

InChI=1S/C12H13N5O2/c1-2-11(18)13-6-5-12(19)14-8-3-4-9-10(7-8)16-17-15-9/h2-4,7H,1,5-6H2,(H,13,18)(H,14,19)(H,15,16,17)