[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] (E)-3-(5-bromanylthiophen-2-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] (E)-3-(5-bromanylthiophen-2-yl)prop-2-enoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] (E)-3-(5-bromo-2-thienyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-thiophenyl)-2-propenoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] (E)-3-(5-bromothiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-thienyl)acrylic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C14H18BrNO3S MolecularWeight: 360.26662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C=CC1=CC=C(S1)Br

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)/C=C/C1=CC=C(S1)Br

InChI

InChI=1S/C14H18BrNO3S/c1-3-10(4-2)16-13(17)9-19-14(18)8-6-11-5-7-12(15)20-11/h5-8,10H,3-4,9H2,1-2H3,(H,16,17)/b8-6+