1-[(S)-(4-bromophenyl)-piperidin-1-ium-1-yl-methyl]naphthalen-2-ol

Systemtic Name: 1-[(S)-(4-bromophenyl)-piperidin-1-ium-1-yl-methyl]naphthalen-2-ol Openeye Name: 1-[(S)-(4-bromophenyl)-piperidin-1-ium-1-yl-methyl]naphthalen-2-ol CAS Name: 1-[(S)-(4-bromophenyl)-(1-piperidin-1-iumyl)methyl]-2-naphthalenol IUPAC Name: 1-[(S)-(4-bromophenyl)-piperidin-1-ium-1-ylmethyl]naphthalen-2-ol Traditional Name: 1-[(S)-(4-bromophenyl)-piperidin-1-ium-1-yl-methyl]-2-naphthol Formula: C22H23BrNO+ MolecularWeight: 397.32812

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(C2=CC=C(C=C2)Br)C3=C(C=CC4=CC=CC=C43)O

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](C2=CC=C(C=C2)Br)C3=C(C=CC4=CC=CC=C43)O

InChI

InChI=1S/C22H22BrNO/c23-18-11-8-17(9-12-18)22(24-14-4-1-5-15-24)21-19-7-3-2-6-16(19)10-13-20(21)25/h2-3,6-13,22,25H,1,4-5,14-15H2/p+1/t22-/m0/s1