[4-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-phenyl-methanone

Systemtic Name: [4-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-phenyl-methanone Openeye Name: [4-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-hydroxy-propoxy]phenyl]-phenyl-methanone CAS Name: [4-[3-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]-phenylmethanone IUPAC Name: [4-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]-phenylmethanone Traditional Name: [4-[3-[4-(2,3-dimethylphenyl)piperazino]-2-hydroxy-propoxy]phenyl]-phenyl-methanone Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32N2O3/c1-21-7-6-10-27(22(21)2)30-17-15-29(16-18-30)19-25(31)20-33-26-13-11-24(12-14-26)28(32)23-8-4-3-5-9-23/h3-14,25,31H,15-20H2,1-2H3