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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH+](CC2=C(C=CS2)C)CC(C)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH+](CC2=C(C=CS2)C)C[C@H](C)O)C

InChI

InChI=1S/C18H25NOS/c1-13-5-6-17(9-15(13)3)11-19(10-16(4)20)12-18-14(2)7-8-21-18/h5-9,16,20H,10-12H2,1-4H3/p+1/t16-/m0/s1