8-[(3-chlorophenyl)methoxy]-2-[4-(phenylmethyl)piperidin-1-yl]quinolin-1-ium

Systemtic Name: 8-[(3-chlorophenyl)methoxy]-2-[4-(phenylmethyl)piperidin-1-yl]quinolin-1-ium Openeye Name: 2-(4-benzyl-1-piperidyl)-8-[(3-chlorophenyl)methoxy]quinolin-1-ium CAS Name: 8-[(3-chlorophenyl)methoxy]-2-[4-(phenylmethyl)-1-piperidinyl]quinolin-1-ium IUPAC Name: 2-(4-benzylpiperidin-1-yl)-8-[(3-chlorophenyl)methoxy]quinolin-1-ium Traditional Name: 2-(4-benzylpiperidino)-8-(3-chlorobenzyl)oxy-quinolin-1-ium Formula: C28H28ClN2O+ MolecularWeight: 443.98772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=[NH+]C4=C(C=CC=C4OCC5=CC(=CC=C5)Cl)C=C3

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=[NH+]C4=C(C=CC=C4OCC5=CC(=CC=C5)Cl)C=C3

InChI

InChI=1S/C28H27ClN2O/c29-25-10-4-8-23(19-25)20-32-26-11-5-9-24-12-13-27(30-28(24)26)31-16-14-22(15-17-31)18-21-6-2-1-3-7-21/h1-13,19,22H,14-18,20H2/p+1