3-methoxy-4-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde

Systemtic Name: 3-methoxy-4-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde Openeye Name: 3-methoxy-4-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde CAS Name: 3-methoxy-4-[2-(1-pyrrolidin-1-iumyl)ethoxy]benzaldehyde IUPAC Name: 3-methoxy-4-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde Traditional Name: 3-methoxy-4-(2-pyrrolidin-1-ium-1-ylethoxy)benzaldehyde Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=O)OCC[NH+]2CCCC2

Isomeric SMILES

COC1=C(C=CC(=C1)C=O)OCC[NH+]2CCCC2

InChI

InChI=1S/C14H19NO3/c1-17-14-10-12(11-16)4-5-13(14)18-9-8-15-6-2-3-7-15/h4-5,10-11H,2-3,6-9H2,1H3/p+1