4-methoxy-3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzaldehyde

Systemtic Name: 4-methoxy-3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzaldehyde Openeye Name: 4-methoxy-3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzaldehyde CAS Name: 4-methoxy-3-[(4-methyl-1-piperidin-1-iumyl)methyl]benzaldehyde IUPAC Name: 4-methoxy-3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzaldehyde Traditional Name: 4-methoxy-3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzaldehyde Formula: C15H22NO2+ MolecularWeight: 248.34068

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(C=CC(=C2)C=O)OC

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(C=CC(=C2)C=O)OC

InChI

InChI=1S/C15H21NO2/c1-12-5-7-16(8-6-12)10-14-9-13(11-17)3-4-15(14)18-2/h3-4,9,11-12H,5-8,10H2,1-2H3/p+1