(2R)-2-[[2-(4-cyclohexylphenoxy)phenyl]sulfonylamino]-3-oxidanylidene-propanoic acid

Systemtic Name: (2R)-2-[[2-(4-cyclohexylphenoxy)phenyl]sulfonylamino]-3-oxidanylidene-propanoic acid Openeye Name: (2R)-2-[[2-(4-cyclohexylphenoxy)phenyl]sulfonylamino]-3-oxo-propanoic acid CAS Name: (2R)-2-[[2-(4-cyclohexylphenoxy)phenyl]sulfonylamino]-3-oxopropanoic acid IUPAC Name: (2R)-2-[[2-(4-cyclohexylphenoxy)phenyl]sulfonylamino]-3-oxopropanoic acid Traditional Name: (2R)-2-[[2-(4-cyclohexylphenoxy)phenyl]sulfonylamino]-3-keto-propionic acid Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OC3=CC=CC=C3S(=O)(=O)NC(C=O)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OC3=CC=CC=C3S(=O)(=O)N[C@H](C=O)C(=O)O

InChI

InChI=1S/C21H23NO6S/c23-14-18(21(24)25)22-29(26,27)20-9-5-4-8-19(20)28-17-12-10-16(11-13-17)15-6-2-1-3-7-15/h4-5,8-15,18,22H,1-3,6-7H2,(H,24,25)/t18-/m1/s1