(Z)-3-[3-chloranyl-5-methoxy-4-(2-piperidin-1-ylethoxy)phenyl]-2-cyano-prop-2-enoic acid

Systemtic Name: (Z)-3-[3-chloranyl-5-methoxy-4-(2-piperidin-1-ylethoxy)phenyl]-2-cyano-prop-2-enoic acid Openeye Name: (Z)-3-[3-chloro-5-methoxy-4-[2-(1-piperidyl)ethoxy]phenyl]-2-cyano-prop-2-enoic acid CAS Name: (Z)-3-[3-chloro-5-methoxy-4-[2-(1-piperidinyl)ethoxy]phenyl]-2-cyano-2-propenoic acid IUPAC Name: (Z)-3-[3-chloro-5-methoxy-4-(2-piperidin-1-ylethoxy)phenyl]-2-cyanoprop-2-enoic acid Traditional Name: (Z)-3-[3-chloro-5-methoxy-4-(2-piperidinoethoxy)phenyl]-2-cyano-acrylic acid Formula: C18H21ClN2O4 MolecularWeight: 364.82334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)O)Cl)OCCN2CCCCC2

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(/C#N)\C(=O)O)Cl)OCCN2CCCCC2

InChI

InChI=1S/C18H21ClN2O4/c1-24-16-11-13(9-14(12-20)18(22)23)10-15(19)17(16)25-8-7-21-5-3-2-4-6-21/h9-11H,2-8H2,1H3,(H,22,23)/b14-9-