(4-ethylphenyl)methyl-methyl-[2-oxidanylidene-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]azanium

Systemtic Name: (4-ethylphenyl)methyl-methyl-[2-oxidanylidene-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]azanium Openeye Name: (4-ethylphenyl)methyl-methyl-[2-oxo-2-[[(1R)-1-(2-thienyl)ethyl]amino]ethyl]ammonium CAS Name: (4-ethylphenyl)methyl-methyl-[2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]ammonium IUPAC Name: (4-ethylphenyl)methyl-methyl-[2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]azanium Traditional Name: (4-ethylbenzyl)-[2-keto-2-[[(1R)-1-(2-thienyl)ethyl]amino]ethyl]-methyl-ammonium Formula: C18H25N2OS+ MolecularWeight: 317.4689

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)NC(C)C2=CC=CS2

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)N[C@H](C)C2=CC=CS2

InChI

InChI=1S/C18H24N2OS/c1-4-15-7-9-16(10-8-15)12-20(3)13-18(21)19-14(2)17-6-5-11-22-17/h5-11,14H,4,12-13H2,1-3H3,(H,19,21)/p+1/t14-/m1/s1