1-[(2-methylphenyl)-phenyl-methoxy]-3-[4-(4-nitrophenyl)piperazin-1-yl]propan-2-ol

Systemtic Name: 1-[(2-methylphenyl)-phenyl-methoxy]-3-[4-(4-nitrophenyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-3-[o-tolyl(phenyl)methoxy]propan-2-ol CAS Name: 1-[(2-methylphenyl)-phenylmethoxy]-3-[4-(4-nitrophenyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-[(2-methylphenyl)-phenylmethoxy]-3-[4-(4-nitrophenyl)piperazin-1-yl]propan-2-ol Traditional Name: 1-[4-(4-nitrophenyl)piperazino]-3-[o-tolyl(phenyl)methoxy]propan-2-ol Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC=CC=C2)OCC(CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC=CC=C2)OCC(CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C27H31N3O4/c1-21-7-5-6-10-26(21)27(22-8-3-2-4-9-22)34-20-25(31)19-28-15-17-29(18-16-28)23-11-13-24(14-12-23)30(32)33/h2-14,25,27,31H,15-20H2,1H3