N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-1-phenyl-1,2,3,4-tetrazol-5-amine

Systemtic Name: N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-1-phenyl-1,2,3,4-tetrazol-5-amine Openeye Name: N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-1-phenyl-tetrazol-5-amine CAS Name: N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-1-phenyl-5-tetrazolamine IUPAC Name: N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-1-phenyltetrazol-5-amine Traditional Name: [(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl-(1-phenyltetrazol-5-yl)amine Formula: C19H21N5O2 MolecularWeight: 351.40234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CNC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C19H21N5O2/c1-3-25-17-10-14-9-13(2)26-18(14)11-15(17)12-20-19-21-22-23-24(19)16-7-5-4-6-8-16/h4-8,10-11,13H,3,9,12H2,1-2H3,(H,20,21,23)/t13-/m0/s1