(2S)-1-[4-(3-methylphenyl)piperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-[4-(3-methylphenyl)piperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol Openeye Name: (2S)-1-[4-(m-tolyl)piperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol CAS Name: (2S)-1-[4-(3-methylphenyl)-1-piperazinyl]-3-(4-phenylphenoxy)-2-propanol IUPAC Name: (2S)-1-[4-(3-methylphenyl)piperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol Traditional Name: (2S)-1-[4-(m-tolyl)piperazino]-3-(4-phenylphenoxy)propan-2-ol Formula: C26H30N2O2 MolecularWeight: 402.5286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC(COC3=CC=C(C=C3)C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C[C@@H](COC3=CC=C(C=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C26H30N2O2/c1-21-6-5-9-24(18-21)28-16-14-27(15-17-28)19-25(29)20-30-26-12-10-23(11-13-26)22-7-3-2-4-8-22/h2-13,18,25,29H,14-17,19-20H2,1H3/t25-/m0/s1