methyl (E,4S)-6-methyl-4-[(4-methylphenyl)sulfonylamino]hept-2-enoate

Systemtic Name: methyl (E,4S)-6-methyl-4-[(4-methylphenyl)sulfonylamino]hept-2-enoate Openeye Name: methyl (E,4S)-6-methyl-4-(p-tolylsulfonylamino)hept-2-enoate CAS Name: (E,4S)-6-methyl-4-[(4-methylphenyl)sulfonylamino]-2-heptenoic acid methyl ester IUPAC Name: methyl (E,4S)-6-methyl-4-[(4-methylphenyl)sulfonylamino]hept-2-enoate Traditional Name: (E,4S)-6-methyl-4-(tosylamino)hept-2-enoic acid methyl ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C=CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC(C)C)/C=C/C(=O)OC

InChI

InChI=1S/C16H23NO4S/c1-12(2)11-14(7-10-16(18)21-4)17-22(19,20)15-8-5-13(3)6-9-15/h5-10,12,14,17H,11H2,1-4H3/b10-7+/t14-/m1/s1