methyl (E)-3-[6-(4-bromanylbutanoylamino)pyridin-3-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[6-(4-bromanylbutanoylamino)pyridin-3-yl]prop-2-enoate Openeye Name: methyl (E)-3-[6-(4-bromobutanoylamino)-3-pyridyl]prop-2-enoate CAS Name: (E)-3-[6-[(4-bromo-1-oxobutyl)amino]-3-pyridinyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[6-(4-bromobutanoylamino)pyridin-3-yl]prop-2-enoate Traditional Name: (E)-3-[6-(4-bromobutanoylamino)-3-pyridyl]acrylic acid methyl ester Formula: C13H15BrN2O3 MolecularWeight: 327.1738

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CN=C(C=C1)NC(=O)CCCBr

Isomeric SMILES

COC(=O)/C=C/C1=CN=C(C=C1)NC(=O)CCCBr

InChI

InChI=1S/C13H15BrN2O3/c1-19-13(18)7-5-10-4-6-11(15-9-10)16-12(17)3-2-8-14/h4-7,9H,2-3,8H2,1H3,(H,15,16,17)/b7-5+