1-[(4-methylphenyl)sulfonylamino]hexan-2-yl (E)-but-2-enoate

Systemtic Name: 1-[(4-methylphenyl)sulfonylamino]hexan-2-yl (E)-but-2-enoate Openeye Name: 1-[(p-tolylsulfonylamino)methyl]pentyl (E)-but-2-enoate CAS Name: (E)-2-butenoic acid 1-[(4-methylphenyl)sulfonylamino]hexan-2-yl ester IUPAC Name: 1-[(4-methylphenyl)sulfonylamino]hexan-2-yl (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid 1-[(tosylamino)methyl]pentyl ester Formula: C17H25NO4S MolecularWeight: 339.4497

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CNS(=O)(=O)C1=CC=C(C=C1)C)OC(=O)C=CC

Isomeric SMILES

CCCCC(CNS(=O)(=O)C1=CC=C(C=C1)C)OC(=O)/C=C/C

InChI

InChI=1S/C17H25NO4S/c1-4-6-8-15(22-17(19)7-5-2)13-18-23(20,21)16-11-9-14(3)10-12-16/h5,7,9-12,15,18H,4,6,8,13H2,1-3H3/b7-5+