2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-4-propan-2-yl-phenol

Systemtic Name: 2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-4-propan-2-yl-phenol Openeye Name: 4-isopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol CAS Name: 2-[(4-phenyl-1-piperazin-1-iumyl)methyl]-4-propan-2-ylphenol IUPAC Name: 2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-4-propan-2-ylphenol Traditional Name: 4-isopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)O)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)O)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H26N2O/c1-16(2)17-8-9-20(23)18(14-17)15-21-10-12-22(13-11-21)19-6-4-3-5-7-19/h3-9,14,16,23H,10-13,15H2,1-2H3/p+1