methyl 3-[(5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)carbonylamino]benzoate Openeye Name: methyl 3-[[5-(1-piperidylsulfonyl)-2-pyrrolidin-1-yl-benzoyl]amino]benzoate CAS Name: 3-[[oxo-[5-(1-piperidinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-ylbenzoyl)amino]benzoate Traditional Name: 3-[(5-piperidinosulfonyl-2-pyrrolidino-benzoyl)amino]benzoic acid methyl ester Formula: C24H29N3O5S MolecularWeight: 471.56916

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCCC4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCCC4

InChI

InChI=1S/C24H29N3O5S/c1-32-24(29)18-8-7-9-19(16-18)25-23(28)21-17-20(10-11-22(21)26-12-5-6-13-26)33(30,31)27-14-3-2-4-15-27/h7-11,16-17H,2-6,12-15H2,1H3,(H,25,28)