5-chloranyl-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde

Systemtic Name: 5-chloranyl-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde Openeye Name: 5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde CAS Name: 5-chloro-2-[2-(1-pyrrolidin-1-iumyl)ethoxy]benzaldehyde IUPAC Name: 5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde Traditional Name: 5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde Formula: C13H17ClNO2+ MolecularWeight: 254.73258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO2/c14-12-3-4-13(11(9-12)10-16)17-8-7-15-5-1-2-6-15/h3-4,9-10H,1-2,5-8H2/p+1