4-(azepan-1-ylsulfonyl)-2,1,3-benzoxadiazole

Systemtic Name: 4-(azepan-1-ylsulfonyl)-2,1,3-benzoxadiazole Openeye Name: 4-(azepan-1-ylsulfonyl)-2,1,3-benzoxadiazole CAS Name: 4-(1-azepanylsulfonyl)-2,1,3-benzoxadiazole IUPAC Name: 4-(azepan-1-ylsulfonyl)-2,1,3-benzoxadiazole Traditional Name: 4-(azepan-1-ylsulfonyl)benzofurazan Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC3=NON=C32

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC3=NON=C32

InChI

InChI=1S/C12H15N3O3S/c16-19(17,15-8-3-1-2-4-9-15)11-7-5-6-10-12(11)14-18-13-10/h5-7H,1-4,8-9H2