[(E,4S)-2,6-dimethyl-4-[(4-methylphenyl)sulfonylamino]hept-2-enyl] methanesulfonate

Systemtic Name: [(E,4S)-2,6-dimethyl-4-[(4-methylphenyl)sulfonylamino]hept-2-enyl] methanesulfonate Openeye Name: [(E,4S)-2,6-dimethyl-4-(p-tolylsulfonylamino)hept-2-enyl] methanesulfonate CAS Name: methanesulfonic acid [(E,4S)-2,6-dimethyl-4-[(4-methylphenyl)sulfonylamino]hept-2-enyl] ester IUPAC Name: [(E,4S)-2,6-dimethyl-4-[(4-methylphenyl)sulfonylamino]hept-2-enyl] methanesulfonate Traditional Name: methanesulfonic acid [(E,4S)-2,6-dimethyl-4-(tosylamino)hept-2-enyl] ester Formula: C17H27NO5S2 MolecularWeight: 389.52998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO5S2/c1-13(2)10-16(11-15(4)12-23-24(5,19)20)18-25(21,22)17-8-6-14(3)7-9-17/h6-9,11,13,16,18H,10,12H2,1-5H3/b15-11+/t16-/m0/s1