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

Systemtic Name: 3-[2-(2-methoxy-5-methyl-phenyl)-2-oxidanylidene-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one Openeye Name: 3-[2-(2-methoxy-5-methyl-phenyl)-2-oxo-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one CAS Name: 3-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-2-one IUPAC Name: 3-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one Traditional Name: 3-[2-keto-2-(2-methoxy-5-methyl-phenyl)ethyl]-6-pyrrolidinosulfonyl-1,3-benzoxazol-2-one Formula: C21H22N2O6S MolecularWeight: 430.47418

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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)N4CCCC4)OC2=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)OC2=O

InChI

InChI=1S/C21H22N2O6S/c1-14-5-8-19(28-2)16(11-14)18(24)13-23-17-7-6-15(12-20(17)29-21(23)25)30(26,27)22-9-3-4-10-22/h5-8,11-12H,3-4,9-10,13H2,1-2H3