N-phenethyl-3-(1,2,3,4-tetrazol-1-yl)-5-(2,3,4-trimethoxyphenyl)benzamide

Systemtic Name: N-phenethyl-3-(1,2,3,4-tetrazol-1-yl)-5-(2,3,4-trimethoxyphenyl)benzamide Openeye Name: N-phenethyl-3-(tetrazol-1-yl)-5-(2,3,4-trimethoxyphenyl)benzamide CAS Name: N-phenethyl-3-(1-tetrazolyl)-5-(2,3,4-trimethoxyphenyl)benzamide IUPAC Name: N-phenethyl-3-(tetrazol-1-yl)-5-(2,3,4-trimethoxyphenyl)benzamide Traditional Name: N-phenethyl-3-(tetrazol-1-yl)-5-(2,3,4-trimethoxyphenyl)benzamide Formula: C25H25N5O4 MolecularWeight: 459.4971

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=CC(=CC(=C2)N3C=NN=N3)C(=O)NCCC4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=CC(=CC(=C2)N3C=NN=N3)C(=O)NCCC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C25H25N5O4/c1-32-22-10-9-21(23(33-2)24(22)34-3)18-13-19(15-20(14-18)30-16-27-28-29-30)25(31)26-12-11-17-7-5-4-6-8-17/h4-10,13-16H,11-12H2,1-3H3,(H,26,31)