3-[5-chloranyl-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]propanoate

Systemtic Name: 3-[5-chloranyl-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]propanoate Openeye Name: 3-[5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]propanoate CAS Name: 3-[5-chloro-2-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenyl]propanoate IUPAC Name: 3-[5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]propanoate Traditional Name: 3-[5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]propionate Formula: C15H20ClNO3 MolecularWeight: 297.7772

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=C(C=C(C=C2)Cl)CCC(=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CCOC2=C(C=C(C=C2)Cl)CCC(=O)[O-]

InChI

InChI=1S/C15H20ClNO3/c16-13-4-5-14(12(11-13)3-6-15(18)19)20-10-9-17-7-1-2-8-17/h4-5,11H,1-3,6-10H2,(H,18,19)