2-propyl-3-[[4-(2H-1,2,3,4-tetrazol-5-yl)phenoxy]methyl]cyclohexa-1,3-dien-1-ol

Systemtic Name: 2-propyl-3-[[4-(2H-1,2,3,4-tetrazol-5-yl)phenoxy]methyl]cyclohexa-1,3-dien-1-ol Openeye Name: 2-propyl-3-[[4-(2H-tetrazol-5-yl)phenoxy]methyl]cyclohexa-1,3-dien-1-ol CAS Name: 2-propyl-3-[[4-(2H-tetrazol-5-yl)phenoxy]methyl]-1-cyclohexa-1,3-dienol IUPAC Name: 2-propyl-3-[[4-(2H-tetrazol-5-yl)phenoxy]methyl]cyclohexa-1,3-dien-1-ol Traditional Name: 2-propyl-3-[[4-(2H-tetrazol-5-yl)phenoxy]methyl]cyclohexa-1,3-dien-1-ol Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(CCC=C1COC2=CC=C(C=C2)C3=NNN=N3)O

Isomeric SMILES

CCCC1=C(CCC=C1COC2=CC=C(C=C2)C3=NNN=N3)O

InChI

InChI=1S/C17H20N4O2/c1-2-4-15-13(5-3-6-16(15)22)11-23-14-9-7-12(8-10-14)17-18-20-21-19-17/h5,7-10,22H,2-4,6,11H2,1H3,(H,18,19,20,21)