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

Systemtic Name: ethyl 3-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]benzoate Openeye Name: ethyl 3-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]benzoate CAS Name: 3-[[[2-methyl-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2-methyl-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 3-[(2-methyl-5-pyrrolidinosulfonyl-benzoyl)amino]benzoic acid ethyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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