3-(2,2-dimethyloxan-4-yl)-3-phenyl-1-[(2R)-2-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(2,2-dimethyloxan-4-yl)-3-phenyl-1-[(2R)-2-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-[(2R)-2-benzylpiperazin-1-yl]-3-(2,2-dimethyltetrahydropyran-4-yl)-3-phenyl-propan-1-one CAS Name: 3-(2,2-dimethyl-4-oxanyl)-3-phenyl-1-[(2R)-2-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-[(2R)-2-benzylpiperazin-1-yl]-3-(2,2-dimethyloxan-4-yl)-3-phenylpropan-1-one Traditional Name: 1-[(2R)-2-benzylpiperazino]-3-(2,2-dimethyltetrahydropyran-4-yl)-3-phenyl-propan-1-one Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)C(CC(=O)N2CCNCC2CC3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(CCO1)C(CC(=O)N2CCNC[C@H]2CC3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C27H36N2O2/c1-27(2)19-23(13-16-31-27)25(22-11-7-4-8-12-22)18-26(30)29-15-14-28-20-24(29)17-21-9-5-3-6-10-21/h3-12,23-25,28H,13-20H2,1-2H3/t23?,24-,25?/m1/s1