4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-morpholin-4-ylsulfonyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-morpholin-4-ylsulfonyl-1,4-benzoxazin-3-one Openeye Name: 4-[2-(azepan-1-yl)-2-oxo-ethyl]-6-morpholinosulfonyl-1,4-benzoxazin-3-one CAS Name: 4-[2-(1-azepanyl)-2-oxoethyl]-6-(4-morpholinylsulfonyl)-1,4-benzoxazin-3-one IUPAC Name: 4-[2-(azepan-1-yl)-2-oxoethyl]-6-morpholin-4-ylsulfonyl-1,4-benzoxazin-3-one Traditional Name: 4-[2-(azepan-1-yl)-2-keto-ethyl]-6-morpholinosulfonyl-1,4-benzoxazin-3-one Formula: C20H27N3O6S MolecularWeight: 437.50988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C(=O)COC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=O)COC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H27N3O6S/c24-19(21-7-3-1-2-4-8-21)14-23-17-13-16(5-6-18(17)29-15-20(23)25)30(26,27)22-9-11-28-12-10-22/h5-6,13H,1-4,7-12,14-15H2