1-[(2S,5R)-2,5-dimethyl-4-naphthalen-2-ylcarbonyl-piperazin-1-yl]ethanone

Systemtic Name: 1-[(2S,5R)-2,5-dimethyl-4-naphthalen-2-ylcarbonyl-piperazin-1-yl]ethanone Openeye Name: 1-[(2S,5R)-2,5-dimethyl-4-(naphthalene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 1-[(2S,5R)-2,5-dimethyl-4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]ethanone IUPAC Name: 1-[(2S,5R)-2,5-dimethyl-4-(naphthalene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 1-[(2S,5R)-2,5-dimethyl-4-(2-naphthoyl)piperazino]ethanone Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)C2=CC3=CC=CC=C3C=C2)C)C(=O)C

Isomeric SMILES

C[C@@H]1CN([C@H](CN1C(=O)C2=CC3=CC=CC=C3C=C2)C)C(=O)C

InChI

InChI=1S/C19H22N2O2/c1-13-12-21(14(2)11-20(13)15(3)22)19(23)18-9-8-16-6-4-5-7-17(16)10-18/h4-10,13-14H,11-12H2,1-3H3/t13-,14+/m0/s1