5-chloranyl-2-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethoxy]benzaldehyde

Systemtic Name: 5-chloranyl-2-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethoxy]benzaldehyde Openeye Name: 2-[2-(4-benzylpiperidin-1-ium-1-yl)ethoxy]-5-chloro-benzaldehyde CAS Name: 5-chloro-2-[2-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethoxy]benzaldehyde IUPAC Name: 2-[2-(4-benzylpiperidin-1-ium-1-yl)ethoxy]-5-chlorobenzaldehyde Traditional Name: 2-[2-(4-benzylpiperidin-1-ium-1-yl)ethoxy]-5-chloro-benzaldehyde Formula: C21H25ClNO2+ MolecularWeight: 358.8817

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CCOC3=C(C=C(C=C3)Cl)C=O

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CCOC3=C(C=C(C=C3)Cl)C=O

InChI

InChI=1S/C21H24ClNO2/c22-20-6-7-21(19(15-20)16-24)25-13-12-23-10-8-18(9-11-23)14-17-4-2-1-3-5-17/h1-7,15-16,18H,8-14H2/p+1