2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-3-methyl-pentanoic acid

Systemtic Name: 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-3-methyl-pentanoic acid Openeye Name: 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[(E)-3-(4-bromophenyl)acryloyl]amino]-3-methyl-valeric acid Formula: C15H18BrNO3 MolecularWeight: 340.21232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C=CC1=CC=C(C=C1)Br

Isomeric SMILES

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

InChI

InChI=1S/C15H18BrNO3/c1-3-10(2)14(15(19)20)17-13(18)9-6-11-4-7-12(16)8-5-11/h4-10,14H,3H2,1-2H3,(H,17,18)(H,19,20)/b9-6+