(E)-3-[2-[(3S)-3-aminocarbonylpiperidin-1-yl]-6-chloranyl-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[2-[(3S)-3-aminocarbonylpiperidin-1-yl]-6-chloranyl-phenyl]prop-2-enoate Openeye Name: (E)-3-[2-[(3S)-3-carbamoyl-1-piperidyl]-6-chloro-phenyl]prop-2-enoate CAS Name: (E)-3-[2-[(3S)-3-carbamoyl-1-piperidinyl]-6-chlorophenyl]-2-propenoate IUPAC Name: (E)-3-[2-[(3S)-3-carbamoylpiperidin-1-yl]-6-chlorophenyl]prop-2-enoate Traditional Name: (E)-3-[2-[(3S)-3-carbamoylpiperidino]-6-chloro-phenyl]acrylate Formula: C15H16ClN2O3- MolecularWeight: 307.75214

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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

C1C[C@@H](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)/p-1/b7-6+/t10-/m0/s1