methyl 6-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]hexanoate

Systemtic Name: methyl 6-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]hexanoate Openeye Name: methyl 6-[[(E)-3-(5-bromo-2-thienyl)prop-2-enoyl]amino]hexanoate CAS Name: 6-[[(E)-3-(5-bromo-2-thiophenyl)-1-oxoprop-2-enyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(E)-3-(5-bromothiophen-2-yl)prop-2-enoyl]amino]hexanoate Traditional Name: 6-[[(E)-3-(5-bromo-2-thienyl)acryloyl]amino]hexanoic acid methyl ester Formula: C14H18BrNO3S MolecularWeight: 360.26662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C=CC1=CC=C(S1)Br

Isomeric SMILES

COC(=O)CCCCCNC(=O)/C=C/C1=CC=C(S1)Br

InChI

InChI=1S/C14H18BrNO3S/c1-19-14(18)5-3-2-4-10-16-13(17)9-7-11-6-8-12(15)20-11/h6-9H,2-5,10H2,1H3,(H,16,17)/b9-7+