7-[3-(azepan-1-yl)-3-oxidanylidene-propyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-[3-(azepan-1-yl)-3-oxidanylidene-propyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one Openeye Name: 7-[3-(azepan-1-yl)-3-oxo-propyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one CAS Name: 7-[3-(1-azepanyl)-3-oxopropyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one IUPAC Name: 7-[3-(azepan-1-yl)-3-oxopropyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one Traditional Name: 7-[3-(azepan-1-yl)-3-keto-propyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)CCC(=O)N3CCCCCC3)OCC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)CCC(=O)N3CCCCCC3)OCC(=O)N2

InChI

InChI=1S/C18H24N2O5S/c1-13-10-14-15(25-12-17(21)19-14)11-16(13)26(23,24)9-6-18(22)20-7-4-2-3-5-8-20/h10-11H,2-9,12H2,1H3,(H,19,21)