methyl (E)-5-[3-[(4-bromophenyl)sulfonylamino]phenyl]pent-2-en-4-ynoate

Systemtic Name: methyl (E)-5-[3-[(4-bromophenyl)sulfonylamino]phenyl]pent-2-en-4-ynoate Openeye Name: methyl (E)-5-[3-[(4-bromophenyl)sulfonylamino]phenyl]pent-2-en-4-ynoate CAS Name: (E)-5-[3-[(4-bromophenyl)sulfonylamino]phenyl]pent-2-en-4-ynoic acid methyl ester IUPAC Name: methyl (E)-5-[3-[(4-bromophenyl)sulfonylamino]phenyl]pent-2-en-4-ynoate Traditional Name: (E)-5-[3-(brosylamino)phenyl]pent-2-en-4-ynoic acid methyl ester Formula: C18H14BrNO4S MolecularWeight: 420.27706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC#CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)/C=C/C#CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H14BrNO4S/c1-24-18(21)8-3-2-5-14-6-4-7-16(13-14)20-25(22,23)17-11-9-15(19)10-12-17/h3-4,6-13,20H,1H3/b8-3+