5-[[2-(4-methoxyphenyl)-4-nitro-phenoxy]methyl]-1-propyl-1,2,3,4-tetrazole

Systemtic Name: 5-[[2-(4-methoxyphenyl)-4-nitro-phenoxy]methyl]-1-propyl-1,2,3,4-tetrazole Openeye Name: 5-[[2-(4-methoxyphenyl)-4-nitro-phenoxy]methyl]-1-propyl-tetrazole CAS Name: 5-[[2-(4-methoxyphenyl)-4-nitrophenoxy]methyl]-1-propyltetrazole IUPAC Name: 5-[[2-(4-methoxyphenyl)-4-nitrophenoxy]methyl]-1-propyltetrazole Traditional Name: 5-[[2-(4-methoxyphenyl)-4-nitro-phenoxy]methyl]-1-propyl-tetrazole Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C(=NN=N1)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H19N5O4/c1-3-10-22-18(19-20-21-22)12-27-17-9-6-14(23(24)25)11-16(17)13-4-7-15(26-2)8-5-13/h4-9,11H,3,10,12H2,1-2H3