2-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]pentanoic acid

Systemtic Name: 2-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]pentanoic acid Openeye Name: 2-[[(E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoyl]amino]pentanoic acid CAS Name: 2-[[(E)-3-(5-bromo-2-methoxyphenyl)-1-oxoprop-2-enyl]amino]pentanoic acid IUPAC Name: 2-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]pentanoic acid Traditional Name: 2-[[(E)-3-(5-bromo-2-methoxy-phenyl)acryloyl]amino]valeric acid Formula: C15H18BrNO4 MolecularWeight: 356.21172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)C=CC1=C(C=CC(=C1)Br)OC

Isomeric SMILES

CCCC(C(=O)O)NC(=O)/C=C/C1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C15H18BrNO4/c1-3-4-12(15(19)20)17-14(18)8-5-10-9-11(16)6-7-13(10)21-2/h5-9,12H,3-4H2,1-2H3,(H,17,18)(H,19,20)/b8-5+