(E)-3-[5-chloranyl-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-2-thiophen-2-yl-prop-2-enoate

Systemtic Name: (E)-3-[5-chloranyl-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-2-thiophen-2-yl-prop-2-enoate Openeye Name: (E)-3-[5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-2-(2-thienyl)prop-2-enoate CAS Name: (E)-3-[5-chloro-2-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenyl]-2-thiophen-2-yl-2-propenoate IUPAC Name: (E)-3-[5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-2-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-[5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-2-(2-thienyl)acrylate Formula: C19H20ClNO3S MolecularWeight: 377.885

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=C(C=C(C=C2)Cl)C=C(C3=CC=CS3)C(=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CCOC2=C(C=C(C=C2)Cl)/C=C(/C3=CC=CS3)\C(=O)[O-]

InChI

InChI=1S/C19H20ClNO3S/c20-15-5-6-17(24-10-9-21-7-1-2-8-21)14(12-15)13-16(19(22)23)18-4-3-11-25-18/h3-6,11-13H,1-2,7-10H2,(H,22,23)/b16-13-