(phenylmethyl) 3-methyl-4-[(4-methylphenyl)sulfonylamino]cyclopentane-1-carboxylate

Systemtic Name: (phenylmethyl) 3-methyl-4-[(4-methylphenyl)sulfonylamino]cyclopentane-1-carboxylate Openeye Name: benzyl 3-methyl-4-(p-tolylsulfonylamino)cyclopentanecarboxylate CAS Name: 3-methyl-4-[(4-methylphenyl)sulfonylamino]-1-cyclopentanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methyl-4-[(4-methylphenyl)sulfonylamino]cyclopentane-1-carboxylate Traditional Name: 3-methyl-4-(tosylamino)cyclopentanecarboxylic acid benzyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC1NS(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1CC(CC1NS(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H25NO4S/c1-15-8-10-19(11-9-15)27(24,25)22-20-13-18(12-16(20)2)21(23)26-14-17-6-4-3-5-7-17/h3-11,16,18,20,22H,12-14H2,1-2H3