propan-2-yl 4-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]benzoate Openeye Name: isopropyl 4-[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]benzoate CAS Name: 4-[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]benzoate Traditional Name: 4-[3-(4-piperidinosulfonylphenyl)propanoylamino]benzoic acid isopropyl ester Formula: C24H30N2O5S MolecularWeight: 458.5704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C24H30N2O5S/c1-18(2)31-24(28)20-9-11-21(12-10-20)25-23(27)15-8-19-6-13-22(14-7-19)32(29,30)26-16-4-3-5-17-26/h6-7,9-14,18H,3-5,8,15-17H2,1-2H3,(H,25,27)