6-(azepan-1-ylsulfonyl)-3-[2-(3-ethoxyphenyl)-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-(azepan-1-ylsulfonyl)-3-[2-(3-ethoxyphenyl)-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one Openeye Name: 6-(azepan-1-ylsulfonyl)-3-[2-(3-ethoxyphenyl)-2-oxo-ethyl]-1,3-benzoxazol-2-one CAS Name: 6-(1-azepanylsulfonyl)-3-[2-(3-ethoxyphenyl)-2-oxoethyl]-1,3-benzoxazol-2-one IUPAC Name: 6-(azepan-1-ylsulfonyl)-3-[2-(3-ethoxyphenyl)-2-oxoethyl]-1,3-benzoxazol-2-one Traditional Name: 6-(azepan-1-ylsulfonyl)-3-(2-keto-2-m-phenetyl-ethyl)-1,3-benzoxazol-2-one Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCCC4)OC2=O

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCCC4)OC2=O

InChI

InChI=1S/C23H26N2O6S/c1-2-30-18-9-7-8-17(14-18)21(26)16-25-20-11-10-19(15-22(20)31-23(25)27)32(28,29)24-12-5-3-4-6-13-24/h7-11,14-15H,2-6,12-13,16H2,1H3