methyl 4-pyrrolidin-1-yl-3-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]benzoate

Systemtic Name: methyl 4-pyrrolidin-1-yl-3-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]benzoate Openeye Name: methyl 4-pyrrolidin-1-yl-3-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate CAS Name: 3-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]-4-(1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 4-pyrrolidin-1-yl-3-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 4-pyrrolidino-3-[(4-pyrrolidinosulfonylbenzoyl)amino]benzoic acid methyl ester Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H27N3O5S/c1-31-23(28)18-8-11-21(25-12-2-3-13-25)20(16-18)24-22(27)17-6-9-19(10-7-17)32(29,30)26-14-4-5-15-26/h6-11,16H,2-5,12-15H2,1H3,(H,24,27)