6-(azepan-1-ylsulfonyl)-3-[2-(2-methoxy-5-methyl-phenyl)-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-(azepan-1-ylsulfonyl)-3-[2-(2-methoxy-5-methyl-phenyl)-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one Openeye Name: 6-(azepan-1-ylsulfonyl)-3-[2-(2-methoxy-5-methyl-phenyl)-2-oxo-ethyl]-1,3-benzoxazol-2-one CAS Name: 6-(1-azepanylsulfonyl)-3-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-1,3-benzoxazol-2-one IUPAC Name: 6-(azepan-1-ylsulfonyl)-3-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-1,3-benzoxazol-2-one Traditional Name: 6-(azepan-1-ylsulfonyl)-3-[2-keto-2-(2-methoxy-5-methyl-phenyl)ethyl]-1,3-benzoxazol-2-one Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCCC4)OC2=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCCC4)OC2=O

InChI

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