(2S)-2-(diethylamino)-2-(3-methoxy-4-oxidanyl-phenyl)-1-piperazin-1-yl-ethanone

Systemtic Name: (2S)-2-(diethylamino)-2-(3-methoxy-4-oxidanyl-phenyl)-1-piperazin-1-yl-ethanone Openeye Name: (2S)-2-(diethylamino)-2-(4-hydroxy-3-methoxy-phenyl)-1-piperazin-1-yl-ethanone CAS Name: (2S)-2-(diethylamino)-2-(4-hydroxy-3-methoxyphenyl)-1-(1-piperazinyl)ethanone IUPAC Name: (2S)-2-(diethylamino)-2-(4-hydroxy-3-methoxyphenyl)-1-piperazin-1-ylethanone Traditional Name: (2S)-2-(diethylamino)-2-(4-hydroxy-3-methoxy-phenyl)-1-piperazino-ethanone Formula: C17H27N3O3 MolecularWeight: 321.41458

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C1=CC(=C(C=C1)O)OC)C(=O)N2CCNCC2

Isomeric SMILES

CCN(CC)[C@@H](C1=CC(=C(C=C1)O)OC)C(=O)N2CCNCC2

InChI

InChI=1S/C17H27N3O3/c1-4-19(5-2)16(17(22)20-10-8-18-9-11-20)13-6-7-14(21)15(12-13)23-3/h6-7,12,16,18,21H,4-5,8-11H2,1-3H3/t16-/m0/s1