diethyl-[(2R)-3-(2-methylphenoxy)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]azanium

Systemtic Name: diethyl-[(2R)-3-(2-methylphenoxy)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]azanium Openeye Name: diethyl-[(1R)-1-[(2-methylphenoxy)methyl]-2-oxo-2-piperazin-1-yl-ethyl]ammonium CAS Name: diethyl-[(2R)-3-(2-methylphenoxy)-1-oxo-1-(1-piperazinyl)propan-2-yl]ammonium IUPAC Name: diethyl-[(2R)-3-(2-methylphenoxy)-1-oxo-1-piperazin-1-ylpropan-2-yl]azanium Traditional Name: diethyl-[(1R)-2-keto-1-[(2-methylphenoxy)methyl]-2-piperazino-ethyl]ammonium Formula: C18H30N3O2+ MolecularWeight: 320.4497

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(COC1=CC=CC=C1C)C(=O)N2CCNCC2

Isomeric SMILES

CC[NH+](CC)[C@H](COC1=CC=CC=C1C)C(=O)N2CCNCC2

InChI

InChI=1S/C18H29N3O2/c1-4-20(5-2)16(18(22)21-12-10-19-11-13-21)14-23-17-9-7-6-8-15(17)3/h6-9,16,19H,4-5,10-14H2,1-3H3/p+1/t16-/m1/s1