(5-chloranylthiophen-2-yl)methyl-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: (5-chloro-2-thienyl)methyl-[(1S)-1,4-dimethylpentyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: (5-chloro-2-thienyl)methyl-[(1S)-1,4-dimethylpentyl]ammonium Formula: C12H21ClNS+ MolecularWeight: 246.81984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CC1=CC=C(S1)Cl

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CC1=CC=C(S1)Cl

InChI

InChI=1S/C12H20ClNS/c1-9(2)4-5-10(3)14-8-11-6-7-12(13)15-11/h6-7,9-10,14H,4-5,8H2,1-3H3/p+1/t10-/m0/s1