diethyl-[(1S)-1-(4-ethylphenyl)-2-oxidanylidene-2-piperazin-1-yl-ethyl]azanium

Systemtic Name: diethyl-[(1S)-1-(4-ethylphenyl)-2-oxidanylidene-2-piperazin-1-yl-ethyl]azanium Openeye Name: diethyl-[(1S)-1-(4-ethylphenyl)-2-oxo-2-piperazin-1-yl-ethyl]ammonium CAS Name: diethyl-[(1S)-1-(4-ethylphenyl)-2-oxo-2-(1-piperazinyl)ethyl]ammonium IUPAC Name: diethyl-[(1S)-1-(4-ethylphenyl)-2-oxo-2-piperazin-1-ylethyl]azanium Traditional Name: diethyl-[(1S)-1-(4-ethylphenyl)-2-keto-2-piperazino-ethyl]ammonium Formula: C18H30N3O+ MolecularWeight: 304.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(=O)N2CCNCC2)[NH+](CC)CC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H](C(=O)N2CCNCC2)[NH+](CC)CC

InChI

InChI=1S/C18H29N3O/c1-4-15-7-9-16(10-8-15)17(20(5-2)6-3)18(22)21-13-11-19-12-14-21/h7-10,17,19H,4-6,11-14H2,1-3H3/p+1/t17-/m0/s1