[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [2-(2-chloro-4,6-dimethyl-anilino)-2-oxo-ethyl]-methyl-(3-thienylmethyl)ammonium CAS Name: [2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [2-(2-chloro-4,6-dimethyl-anilino)-2-keto-ethyl]-methyl-(3-thenyl)ammonium Formula: C16H20ClN2OS+ MolecularWeight: 323.8608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19ClN2OS/c1-11-6-12(2)16(14(17)7-11)18-15(20)9-19(3)8-13-4-5-21-10-13/h4-7,10H,8-9H2,1-3H3,(H,18,20)/p+1