3-methoxy-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde

Systemtic Name: 3-methoxy-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde Openeye Name: 3-methoxy-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde CAS Name: 3-methoxy-2-[2-[(3S)-3-methyl-1-piperidin-1-iumyl]ethoxy]benzaldehyde IUPAC Name: 3-methoxy-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde Traditional Name: 3-methoxy-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde Formula: C16H24NO3+ MolecularWeight: 278.36666

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCOC2=C(C=CC=C2OC)C=O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCOC2=C(C=CC=C2OC)C=O

InChI

InChI=1S/C16H23NO3/c1-13-5-4-8-17(11-13)9-10-20-16-14(12-18)6-3-7-15(16)19-2/h3,6-7,12-13H,4-5,8-11H2,1-2H3/p+1/t13-/m0/s1