1-[(2S)-6-(diethylaminomethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-phenethyl-piperazin-2-one

Systemtic Name: 1-[(2S)-6-(diethylaminomethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-phenethyl-piperazin-2-one Openeye Name: 1-[(2S)-6-(diethylaminomethyl)tetralin-2-yl]-4-phenethyl-piperazin-2-one CAS Name: 1-[(2S)-6-(diethylaminomethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-phenethyl-2-piperazinone IUPAC Name: 1-[(2S)-6-(diethylaminomethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-phenethylpiperazin-2-one Traditional Name: 1-[(2S)-6-(diethylaminomethyl)tetralin-2-yl]-4-phenethyl-piperazin-2-one Formula: C27H37N3O MolecularWeight: 419.60218

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC2=C(CC(CC2)N3CCN(CC3=O)CCC4=CC=CC=C4)C=C1

Isomeric SMILES

CCN(CC)CC1=CC2=C(C[C@H](CC2)N3CCN(CC3=O)CCC4=CC=CC=C4)C=C1

InChI

InChI=1S/C27H37N3O/c1-3-28(4-2)20-23-10-11-25-19-26(13-12-24(25)18-23)30-17-16-29(21-27(30)31)15-14-22-8-6-5-7-9-22/h5-11,18,26H,3-4,12-17,19-21H2,1-2H3/t26-/m0/s1