2-[5-(4-butoxyphenyl)-1,2,3,4-tetrazol-2-yl]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[5-(4-butoxyphenyl)-1,2,3,4-tetrazol-2-yl]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[5-(4-butoxyphenyl)tetrazol-2-yl]-N-(3-nitrophenyl)acetamide CAS Name: 2-[5-(4-butoxyphenyl)-2-tetrazolyl]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[5-(4-butoxyphenyl)tetrazol-2-yl]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[5-(4-butoxyphenyl)tetrazol-2-yl]-N-(3-nitrophenyl)acetamide Formula: C19H20N6O4 MolecularWeight: 396.3999

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O4/c1-2-3-11-29-17-9-7-14(8-10-17)19-21-23-24(22-19)13-18(26)20-15-5-4-6-16(12-15)25(27)28/h4-10,12H,2-3,11,13H2,1H3,(H,20,26)