1-(2,2-dimethyl-4-phenyl-oxan-4-yl)-2-[(2R)-2-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 1-(2,2-dimethyl-4-phenyl-oxan-4-yl)-2-[(2R)-2-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-[(2R)-2-benzylpiperazin-1-yl]-1-(2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl)ethanone CAS Name: 1-(2,2-dimethyl-4-phenyl-4-oxanyl)-2-[(2R)-2-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(2R)-2-benzylpiperazin-1-yl]-1-(2,2-dimethyl-4-phenyloxan-4-yl)ethanone Traditional Name: 2-[(2R)-2-benzylpiperazino]-1-(2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl)ethanone Formula: C26H34N2O2 MolecularWeight: 406.56036

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)(C2=CC=CC=C2)C(=O)CN3CCNCC3CC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(CCO1)(C2=CC=CC=C2)C(=O)CN3CCNC[C@H]3CC4=CC=CC=C4)C

InChI

InChI=1S/C26H34N2O2/c1-25(2)20-26(13-16-30-25,22-11-7-4-8-12-22)24(29)19-28-15-14-27-18-23(28)17-21-9-5-3-6-10-21/h3-12,23,27H,13-20H2,1-2H3/t23-,26?/m1/s1