3-[2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one Openeye Name: 3-[2-(4-methoxy-3-nitro-phenyl)-2-oxo-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one CAS Name: 3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-2-one IUPAC Name: 3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one Traditional Name: 3-[2-keto-2-(4-methoxy-3-nitro-phenyl)ethyl]-6-pyrrolidinosulfonyl-1,3-benzoxazol-2-one Formula: C20H19N3O8S MolecularWeight: 461.44516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)OC2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O8S/c1-30-18-7-4-13(10-16(18)23(26)27)17(24)12-22-15-6-5-14(11-19(15)31-20(22)25)32(28,29)21-8-2-3-9-21/h4-7,10-11H,2-3,8-9,12H2,1H3