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

Systemtic Name: (E)-3-[2-chloranyl-6-(3-ethylpiperidin-1-yl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-chloro-6-(3-ethyl-1-piperidyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-chloro-6-(3-ethyl-1-piperidinyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-chloro-6-(3-ethylpiperidin-1-yl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-chloro-6-(3-ethylpiperidino)phenyl]acrylic acid Formula: C16H20ClNO2 MolecularWeight: 293.7885

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCN(C1)C2=C(C(=CC=C2)Cl)C=CC(=O)O

Isomeric SMILES

CCC1CCCN(C1)C2=C(C(=CC=C2)Cl)/C=C/C(=O)O

InChI

InChI=1S/C16H20ClNO2/c1-2-12-5-4-10-18(11-12)15-7-3-6-14(17)13(15)8-9-16(19)20/h3,6-9,12H,2,4-5,10-11H2,1H3,(H,19,20)/b9-8+