(E)-3-[2-(3-aminocarbonylpiperidin-1-yl)-4-bromanyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(3-aminocarbonylpiperidin-1-yl)-4-bromanyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-bromo-2-(3-carbamoyl-1-piperidyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-(3-carbamoyl-1-piperidinyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-bromo-2-(3-carbamoylpiperidin-1-yl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-bromo-2-(3-carbamoylpiperidino)phenyl]acrylic acid Formula: C15H17BrN2O3 MolecularWeight: 353.21108

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=CC(=C2)Br)C=CC(=O)O)C(=O)N

Isomeric SMILES

C1CC(CN(C1)C2=C(C=CC(=C2)Br)/C=C/C(=O)O)C(=O)N

InChI

InChI=1S/C15H17BrN2O3/c16-12-5-3-10(4-6-14(19)20)13(8-12)18-7-1-2-11(9-18)15(17)21/h3-6,8,11H,1-2,7,9H2,(H2,17,21)(H,19,20)/b6-4+