(2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-oxidanyl-2-(2-phenylethanoylamino)propanamide

Systemtic Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-oxidanyl-2-(2-phenylethanoylamino)propanamide Openeye Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-2-[(2-phenylacetyl)amino]propanamide CAS Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-2-[(1-oxo-2-phenylethyl)amino]propanamide IUPAC Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-2-[(2-phenylacetyl)amino]propanamide Traditional Name: (2S)-3-hydroxy-2-[(2-phenylacetyl)amino]-N-piperonyl-propionamide Formula: C19H20N2O5 MolecularWeight: 356.3725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(CO)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)[C@H](CO)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H20N2O5/c22-11-15(21-18(23)9-13-4-2-1-3-5-13)19(24)20-10-14-6-7-16-17(8-14)26-12-25-16/h1-8,15,22H,9-12H2,(H,20,24)(H,21,23)/t15-/m0/s1