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

Systemtic Name: 3-[2-(4-ethoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-6-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-one Openeye Name: 3-[2-(4-ethoxy-3-nitro-phenyl)-2-oxo-ethyl]-6-(1-piperidylsulfonyl)-1,3-benzoxazol-2-one CAS Name: 3-[2-(4-ethoxy-3-nitrophenyl)-2-oxoethyl]-6-(1-piperidinylsulfonyl)-1,3-benzoxazol-2-one IUPAC Name: 3-[2-(4-ethoxy-3-nitrophenyl)-2-oxoethyl]-6-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-one Traditional Name: 3-[2-(4-ethoxy-3-nitro-phenyl)-2-keto-ethyl]-6-piperidinosulfonyl-1,3-benzoxazol-2-one Formula: C22H23N3O8S MolecularWeight: 489.49832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)OC2=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O8S/c1-2-32-20-9-6-15(12-18(20)25(28)29)19(26)14-24-17-8-7-16(13-21(17)33-22(24)27)34(30,31)23-10-4-3-5-11-23/h6-9,12-13H,2-5,10-11,14H2,1H3