2-methylpropyl 3-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: 2-methylpropyl 3-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: isobutyl 3-phenyl-3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: 3-phenyl-3-(tosylamino)propionic acid isobutyl ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)OCC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)OCC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C20H25NO4S/c1-15(2)14-25-20(22)13-19(17-7-5-4-6-8-17)21-26(23,24)18-11-9-16(3)10-12-18/h4-12,15,19,21H,13-14H2,1-3H3