1-[2,5-diethoxy-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylazepane

Systemtic Name: 1-[2,5-diethoxy-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylazepane Openeye Name: 1-[2,5-diethoxy-4-(tetrazol-1-yl)phenyl]sulfonylazepane CAS Name: 1-[2,5-diethoxy-4-(1-tetrazolyl)phenyl]sulfonylazepane IUPAC Name: 1-[2,5-diethoxy-4-(tetrazol-1-yl)phenyl]sulfonylazepane Traditional Name: 1-[2,5-diethoxy-4-(tetrazol-1-yl)phenyl]sulfonylazepane Formula: C17H25N5O4S MolecularWeight: 395.4765

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N2C=NN=N2)OCC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=CC(=C(C=C1N2C=NN=N2)OCC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C17H25N5O4S/c1-3-25-15-12-17(27(23,24)21-9-7-5-6-8-10-21)16(26-4-2)11-14(15)22-13-18-19-20-22/h11-13H,3-10H2,1-2H3