methyl 4-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]benzoate Openeye Name: methyl 4-[[2-methyl-5-(1-piperidylsulfonyl)benzoyl]amino]benzoate CAS Name: 4-[[[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-methyl-5-piperidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 4-[(2-methyl-5-piperidinosulfonyl-benzoyl)amino]benzoic acid methyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H24N2O5S/c1-15-6-11-18(29(26,27)23-12-4-3-5-13-23)14-19(15)20(24)22-17-9-7-16(8-10-17)21(25)28-2/h6-11,14H,3-5,12-13H2,1-2H3,(H,22,24)