ethyl 2-[(6-chloranyl-1-oxidanylidene-3,4-dihydroisochromen-3-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(6-chloranyl-1-oxidanylidene-3,4-dihydroisochromen-3-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(6-chloro-1-oxo-isochromane-3-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(6-chloro-1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(6-chloro-1-oxo-3,4-dihydroisochromene-3-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(6-chloro-1-keto-isochroman-3-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H18ClNO5S MolecularWeight: 407.86792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2CC3=C(C=CC(=C3)Cl)C(=O)O2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2CC3=C(C=CC(=C3)Cl)C(=O)O2

InChI

InChI=1S/C19H18ClNO5S/c1-4-25-19(24)15-9(2)10(3)27-17(15)21-16(22)14-8-11-7-12(20)5-6-13(11)18(23)26-14/h5-7,14H,4,8H2,1-3H3,(H,21,22)