1,1-bis(oxidanylidene)-2-[3-(2-oxidanylideneazepan-1-yl)propyl]-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-[3-(2-oxidanylideneazepan-1-yl)propyl]-1,2-benzothiazol-3-one Openeye Name: 1,1-dioxo-2-[3-(2-oxoazepan-1-yl)propyl]-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-[3-(2-oxo-1-azepanyl)propyl]-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-[3-(2-oxoazepan-1-yl)propyl]-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[3-(2-ketoazepan-1-yl)propyl]-1,2-benzothiazol-3-one Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

C1CCC(=O)N(CC1)CCCN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C16H20N2O4S/c19-15-9-2-1-5-10-17(15)11-6-12-18-16(20)13-7-3-4-8-14(13)23(18,21)22/h3-4,7-8H,1-2,5-6,9-12H2