(E)-3-[2-(4-aminocarbonylpiperidin-1-yl)-6-chloranyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(4-aminocarbonylpiperidin-1-yl)-6-chloranyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(4-carbamoyl-1-piperidyl)-6-chloro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(4-carbamoyl-1-piperidinyl)-6-chlorophenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(4-carbamoylpiperidin-1-yl)-6-chlorophenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(4-carbamoylpiperidino)-6-chloro-phenyl]acrylic acid Formula: C15H17ClN2O3 MolecularWeight: 308.76008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C2=C(C(=CC=C2)Cl)C=CC(=O)O

Isomeric SMILES

C1CN(CCC1C(=O)N)C2=C(C(=CC=C2)Cl)/C=C/C(=O)O

InChI

InChI=1S/C15H17ClN2O3/c16-12-2-1-3-13(11(12)4-5-14(19)20)18-8-6-10(7-9-18)15(17)21/h1-5,10H,6-9H2,(H2,17,21)(H,19,20)/b5-4+