4-[(3S)-3-(4-methylpiperazin-1-ium-1-yl)butyl]phenol

Systemtic Name: 4-[(3S)-3-(4-methylpiperazin-1-ium-1-yl)butyl]phenol Openeye Name: 4-[(3S)-3-(4-methylpiperazin-1-ium-1-yl)butyl]phenol CAS Name: 4-[(3S)-3-(4-methyl-1-piperazin-1-iumyl)butyl]phenol IUPAC Name: 4-[(3S)-3-(4-methylpiperazin-1-ium-1-yl)butyl]phenol Traditional Name: 4-[(3S)-3-(4-methylpiperazin-1-ium-1-yl)butyl]phenol Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)O)[NH+]2CCN(CC2)C

Isomeric SMILES

C[C@@H](CCC1=CC=C(C=C1)O)[NH+]2CCN(CC2)C

InChI

InChI=1S/C15H24N2O/c1-13(17-11-9-16(2)10-12-17)3-4-14-5-7-15(18)8-6-14/h5-8,13,18H,3-4,9-12H2,1-2H3/p+1/t13-/m0/s1