5-[(4-methylphenyl)sulfonylamino]pentyl 6-bromanylhex-5-ynoate

Systemtic Name: 5-[(4-methylphenyl)sulfonylamino]pentyl 6-bromanylhex-5-ynoate Openeye Name: 5-(p-tolylsulfonylamino)pentyl 6-bromohex-5-ynoate CAS Name: 6-bromo-5-hexynoic acid 5-[(4-methylphenyl)sulfonylamino]pentyl ester IUPAC Name: 5-[(4-methylphenyl)sulfonylamino]pentyl 6-bromohex-5-ynoate Traditional Name: 6-bromohex-5-ynoic acid 5-(tosylamino)pentyl ester Formula: C18H24BrNO4S MolecularWeight: 430.35646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCCCOC(=O)CCCC#CBr

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCCCOC(=O)CCCC#CBr

InChI

InChI=1S/C18H24BrNO4S/c1-16-9-11-17(12-10-16)25(22,23)20-14-6-3-7-15-24-18(21)8-4-2-5-13-19/h9-12,20H,2-4,6-8,14-15H2,1H3