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

Systemtic Name: (4-chlorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]-[(2S)-2-oxidanylpropyl]azanium Openeye Name: (4-chlorophenyl)methyl-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: (4-chlorophenyl)methyl-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: (4-chlorophenyl)methyl-[(2S)-2-hydroxypropyl]-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: (4-chlorobenzyl)-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]ammonium Formula: C16H21ClNOS+ MolecularWeight: 310.86204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](CC2=CC=C(C=C2)Cl)CC(C)O

Isomeric SMILES

CC1=C(SC=C1)C[NH+](CC2=CC=C(C=C2)Cl)C[C@H](C)O

InChI

InChI=1S/C16H20ClNOS/c1-12-7-8-20-16(12)11-18(9-13(2)19)10-14-3-5-15(17)6-4-14/h3-8,13,19H,9-11H2,1-2H3/p+1/t13-/m0/s1