6-bromanyl-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]naphthalen-2-ol

Systemtic Name: 6-bromanyl-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]naphthalen-2-ol Openeye Name: 6-bromo-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]naphthalen-2-ol CAS Name: 6-bromo-1-[(4-phenyl-1-piperazin-1-iumyl)methyl]-2-naphthalenol IUPAC Name: 6-bromo-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]naphthalen-2-ol Traditional Name: 6-bromo-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-naphthol Formula: C21H22BrN2O+ MolecularWeight: 398.31618

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC3=C2C=CC(=C3)Br)O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC3=C2C=CC(=C3)Br)O)C4=CC=CC=C4

InChI

InChI=1S/C21H21BrN2O/c22-17-7-8-19-16(14-17)6-9-21(25)20(19)15-23-10-12-24(13-11-23)18-4-2-1-3-5-18/h1-9,14,25H,10-13,15H2/p+1