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

Systemtic Name: 3-methylbut-2-enyl 2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: 3-methylbut-2-enyl 3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid 3-methylbut-2-enyl ester IUPAC Name: 3-methylbut-2-enyl 2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: 3-phenyl-2-(tosylamino)propionic acid 3-methylbut-2-enyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OCC=C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OCC=C(C)C

InChI

InChI=1S/C21H25NO4S/c1-16(2)13-14-26-21(23)20(15-18-7-5-4-6-8-18)22-27(24,25)19-11-9-17(3)10-12-19/h4-13,20,22H,14-15H2,1-3H3