methyl 4-chloranyl-2-(thiophen-3-ylmethylamino)benzoate

Systemtic Name: methyl 4-chloranyl-2-(thiophen-3-ylmethylamino)benzoate Openeye Name: methyl 4-chloro-2-(3-thienylmethylamino)benzoate CAS Name: 4-chloro-2-(3-thiophenylmethylamino)benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-(thiophen-3-ylmethylamino)benzoate Traditional Name: 4-chloro-2-(3-thenylamino)benzoic acid methyl ester Formula: C13H12ClNO2S MolecularWeight: 281.75788

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NCC2=CSC=C2

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NCC2=CSC=C2

InChI

InChI=1S/C13H12ClNO2S/c1-17-13(16)11-3-2-10(14)6-12(11)15-7-9-4-5-18-8-9/h2-6,8,15H,7H2,1H3