methyl 4,5-dimethoxy-2-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]benzoate CAS Name: 4,5-dimethoxy-2-[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]benzoate Traditional Name: 4,5-dimethoxy-2-[3-(4-piperidinosulfonylphenyl)propanoylamino]benzoic acid methyl ester Formula: C24H30N2O7S MolecularWeight: 490.5692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)OC

InChI

InChI=1S/C24H30N2O7S/c1-31-21-15-19(24(28)33-3)20(16-22(21)32-2)25-23(27)12-9-17-7-10-18(11-8-17)34(29,30)26-13-5-4-6-14-26/h7-8,10-11,15-16H,4-6,9,12-14H2,1-3H3,(H,25,27)