5-ethoxy-1-(2-methoxy-4-nitro-phenyl)sulfonyl-3-[3-(oxan-2-yloxy)cyclohexyl]benzimidazol-2-one

Systemtic Name: 5-ethoxy-1-(2-methoxy-4-nitro-phenyl)sulfonyl-3-[3-(oxan-2-yloxy)cyclohexyl]benzimidazol-2-one Openeye Name: 5-ethoxy-1-(2-methoxy-4-nitro-phenyl)sulfonyl-3-(3-tetrahydropyran-2-yloxycyclohexyl)benzimidazol-2-one CAS Name: 5-ethoxy-1-(2-methoxy-4-nitrophenyl)sulfonyl-3-[3-(2-oxanyloxy)cyclohexyl]-2-benzimidazolone IUPAC Name: 5-ethoxy-1-(2-methoxy-4-nitrophenyl)sulfonyl-3-[3-(oxan-2-yloxy)cyclohexyl]benzimidazol-2-one Traditional Name: 5-ethoxy-1-(2-methoxy-4-nitro-phenyl)sulfonyl-3-(3-tetrahydropyran-2-yloxycyclohexyl)benzimidazol-2-one Formula: C27H33N3O9S MolecularWeight: 575.63062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=O)N2C3CCCC(C3)OC4CCCCO4)S(=O)(=O)C5=C(C=C(C=C5)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=O)N2C3CCCC(C3)OC4CCCCO4)S(=O)(=O)C5=C(C=C(C=C5)[N+](=O)[O-])OC

InChI

InChI=1S/C27H33N3O9S/c1-3-37-20-11-12-22-23(17-20)28(18-7-6-8-21(15-18)39-26-9-4-5-14-38-26)27(31)29(22)40(34,35)25-13-10-19(30(32)33)16-24(25)36-2/h10-13,16-18,21,26H,3-9,14-15H2,1-2H3