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

Systemtic Name: 1-[2-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-4-phenylmethoxy-phenyl]ethanone Openeye Name: 1-[4-benzyloxy-2-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-hydroxy-propoxy]phenyl]ethanone CAS Name: 1-[2-[3-[4-(3,4-dimethylphenyl)-1-piperazinyl]-2-hydroxypropoxy]-4-phenylmethoxyphenyl]ethanone IUPAC Name: 1-[2-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]-4-phenylmethoxyphenyl]ethanone Traditional Name: 1-[4-benzoxy-2-[3-[4-(3,4-dimethylphenyl)piperazino]-2-hydroxy-propoxy]phenyl]ethanone Formula: C30H36N2O4 MolecularWeight: 488.61784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)CC(COC3=C(C=CC(=C3)OCC4=CC=CC=C4)C(=O)C)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)CC(COC3=C(C=CC(=C3)OCC4=CC=CC=C4)C(=O)C)O)C

InChI

InChI=1S/C30H36N2O4/c1-22-9-10-26(17-23(22)2)32-15-13-31(14-16-32)19-27(34)21-36-30-18-28(11-12-29(30)24(3)33)35-20-25-7-5-4-6-8-25/h4-12,17-18,27,34H,13-16,19-21H2,1-3H3