methyl 2-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]ethanoate

Systemtic Name: methyl 2-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]ethanoate Openeye Name: methyl 2-[(6-chlorothiochroman-4-yl)amino]acetate CAS Name: 2-[(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)amino]acetate Traditional Name: 2-[(6-chlorothiochroman-4-yl)amino]acetic acid methyl ester Formula: C12H14ClNO2S MolecularWeight: 271.76306

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC1CCSC2=C1C=C(C=C2)Cl

Isomeric SMILES

COC(=O)CNC1CCSC2=C1C=C(C=C2)Cl

InChI

InChI=1S/C12H14ClNO2S/c1-16-12(15)7-14-10-4-5-17-11-3-2-8(13)6-9(10)11/h2-3,6,10,14H,4-5,7H2,1H3