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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)O)Cl)OCCN2CCCC2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(/C#N)\C(=O)O)Cl)OCCN2CCCC2

InChI

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