[(2S)-2-(3-hydroxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]azanium

Systemtic Name: [(2S)-2-(3-hydroxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]azanium Openeye Name: [(2S)-2-(3-hydroxyphenyl)-2-[4-(m-tolyl)piperazin-1-yl]ethyl]ammonium CAS Name: [(2S)-2-(3-hydroxyphenyl)-2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: [(2S)-2-(3-hydroxyphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]azanium Traditional Name: [(2S)-2-(3-hydroxyphenyl)-2-[4-(m-tolyl)piperazino]ethyl]ammonium Formula: C19H26N3O+ MolecularWeight: 312.42924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(C[NH3+])C3=CC(=CC=C3)O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)[C@H](C[NH3+])C3=CC(=CC=C3)O

InChI

InChI=1S/C19H25N3O/c1-15-4-2-6-17(12-15)21-8-10-22(11-9-21)19(14-20)16-5-3-7-18(23)13-16/h2-7,12-13,19,23H,8-11,14,20H2,1H3/p+1/t19-/m1/s1