methyl 3-[(4-methylphenyl)sulfonylamino]-4-pyrrolidin-1-yl-benzoate

Systemtic Name: methyl 3-[(4-methylphenyl)sulfonylamino]-4-pyrrolidin-1-yl-benzoate Openeye Name: methyl 3-(p-tolylsulfonylamino)-4-pyrrolidin-1-yl-benzoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]-4-(1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(4-methylphenyl)sulfonylamino]-4-pyrrolidin-1-ylbenzoate Traditional Name: 4-pyrrolidino-3-(tosylamino)benzoic acid methyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCCC3

InChI

InChI=1S/C19H22N2O4S/c1-14-5-8-16(9-6-14)26(23,24)20-17-13-15(19(22)25-2)7-10-18(17)21-11-3-4-12-21/h5-10,13,20H,3-4,11-12H2,1-2H3