(4-ethylphenyl)methyl-[(3-methylthiophen-2-yl)methyl]-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: (4-ethylphenyl)methyl-[(3-methylthiophen-2-yl)methyl]-[(2S)-2-oxidanylpropyl]azanium Openeye Name: (4-ethylphenyl)methyl-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: (4-ethylphenyl)methyl-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: (4-ethylphenyl)methyl-[(2S)-2-hydroxypropyl]-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: (4-ethylbenzyl)-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]ammonium Formula: C18H26NOS+ MolecularWeight: 304.47014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](CC2=C(C=CS2)C)CC(C)O

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](CC2=C(C=CS2)C)C[C@H](C)O

InChI

InChI=1S/C18H25NOS/c1-4-16-5-7-17(8-6-16)12-19(11-15(3)20)13-18-14(2)9-10-21-18/h5-10,15,20H,4,11-13H2,1-3H3/p+1/t15-/m0/s1