N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(1,2,3,4-tetrazol-1-yl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(1,2,3,4-tetrazol-1-yl)propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(tetrazol-1-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(1-tetrazolyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(tetrazol-1-yl)propanamide Traditional Name: 3-phenyl-N-piperonyl-2-(tetrazol-1-yl)propionamide Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(CC3=CC=CC=C3)N4C=NN=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(CC3=CC=CC=C3)N4C=NN=N4

InChI

InChI=1S/C18H17N5O3/c24-18(19-10-14-6-7-16-17(9-14)26-12-25-16)15(23-11-20-21-22-23)8-13-4-2-1-3-5-13/h1-7,9,11,15H,8,10,12H2,(H,19,24)