ethyl-[(2R)-3-methyl-1-oxidanylidene-1-piperazin-1-yl-butan-2-yl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[(2R)-3-methyl-1-oxidanylidene-1-piperazin-1-yl-butan-2-yl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[(1R)-2-methyl-1-(piperazine-1-carbonyl)propyl]ammonium CAS Name: ethyl-[(2R)-3-methyl-1-oxo-1-(1-piperazinyl)butan-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[(2R)-3-methyl-1-oxo-1-piperazin-1-ylbutan-2-yl]azanium Traditional Name: benzyl-ethyl-[(1R)-2-methyl-1-(piperazine-1-carbonyl)propyl]ammonium Formula: C18H30N3O+ MolecularWeight: 304.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)C(C(C)C)C(=O)N2CCNCC2

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)[C@H](C(C)C)C(=O)N2CCNCC2

InChI

InChI=1S/C18H29N3O/c1-4-20(14-16-8-6-5-7-9-16)17(15(2)3)18(22)21-12-10-19-11-13-21/h5-9,15,17,19H,4,10-14H2,1-3H3/p+1/t17-/m1/s1