2-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[(E)-3-(3-bromophenyl)-1-oxoprop-2-enyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[(E)-3-(3-bromophenyl)acryloyl]amino]-3-hydroxy-propionic acid Formula: C12H12BrNO4 MolecularWeight: 314.13198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C=CC(=O)NC(CO)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H12BrNO4/c13-9-3-1-2-8(6-9)4-5-11(16)14-10(7-15)12(17)18/h1-6,10,15H,7H2,(H,14,16)(H,17,18)/b5-4+