[4-(4-cyanophenyl)phenyl] 4-methoxy-3-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 4-methoxy-3-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 4-methoxy-3-[[(2R)-2-methyl-1-piperidyl]sulfonyl]benzoate CAS Name: 4-methoxy-3-[[(2R)-2-methyl-1-piperidinyl]sulfonyl]benzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-methoxy-3-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzoate Traditional Name: 4-methoxy-3-[(2R)-2-methylpiperidino]sulfonyl-benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)OC

Isomeric SMILES

C[C@@H]1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)OC

InChI

InChI=1S/C27H26N2O5S/c1-19-5-3-4-16-29(19)35(31,32)26-17-23(12-15-25(26)33-2)27(30)34-24-13-10-22(11-14-24)21-8-6-20(18-28)7-9-21/h6-15,17,19H,3-5,16H2,1-2H3/t19-/m1/s1