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

Systemtic Name: 3-bromanyl-5-chloranyl-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde Openeye Name: 3-bromo-5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde CAS Name: 3-bromo-5-chloro-2-[2-(1-pyrrolidin-1-iumyl)ethoxy]benzaldehyde IUPAC Name: 3-bromo-5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde Traditional Name: 3-bromo-5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde Formula: C13H16BrClNO2+ MolecularWeight: 333.62864

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=C(C=C(C=C2C=O)Cl)Br

Isomeric SMILES

C1CC[NH+](C1)CCOC2=C(C=C(C=C2C=O)Cl)Br

InChI

InChI=1S/C13H15BrClNO2/c14-12-8-11(15)7-10(9-17)13(12)18-6-5-16-3-1-2-4-16/h7-9H,1-6H2/p+1