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

Systemtic Name: butyl 4-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]benzoate Openeye Name: butyl 4-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate CAS Name: 4-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 4-[(3-pyrrolidinosulfonylbenzoyl)amino]benzoic acid butyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H26N2O5S/c1-2-3-15-29-22(26)17-9-11-19(12-10-17)23-21(25)18-7-6-8-20(16-18)30(27,28)24-13-4-5-14-24/h6-12,16H,2-5,13-15H2,1H3,(H,23,25)