methyl 4-[[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[4-(1-piperidylsulfonyl)benzoyl]amino]methyl]benzoate CAS Name: 4-[[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4-piperidin-1-ylsulfonylbenzoyl)amino]methyl]benzoate Traditional Name: 4-[[(4-piperidinosulfonylbenzoyl)amino]methyl]benzoic acid methyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H24N2O5S/c1-28-21(25)18-7-5-16(6-8-18)15-22-20(24)17-9-11-19(12-10-17)29(26,27)23-13-3-2-4-14-23/h5-12H,2-4,13-15H2,1H3,(H,22,24)