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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN2O3/c16-12-4-1-5-13(11(12)6-7-14(19)20)18-8-2-3-10(9-18)15(17)21/h1,4-7,10H,2-3,8-9H2,(H2,17,21)(H,19,20)/b7-6+