ethyl (3Z)-2-azanyl-6-chloranyl-3-(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-ylidene)-1-benzofuran-2-carboxylate

Systemtic Name: ethyl (3Z)-2-azanyl-6-chloranyl-3-(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-ylidene)-1-benzofuran-2-carboxylate Openeye Name: ethyl (3Z)-2-amino-3-(1-benzyl-2-methoxy-2-oxo-ethylidene)-6-chloro-benzofuran-2-carboxylate CAS Name: (3Z)-2-amino-6-chloro-3-(1-methoxy-1-oxo-3-phenylpropan-2-ylidene)-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl (3Z)-2-amino-6-chloro-3-(1-methoxy-1-oxo-3-phenylpropan-2-ylidene)-1-benzofuran-2-carboxylate Traditional Name: (3Z)-2-amino-3-(1-benzyl-2-keto-2-methoxy-ethylidene)-6-chloro-coumaran-2-carboxylic acid ethyl ester Formula: C21H20ClNO5 MolecularWeight: 401.8402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=C(CC2=CC=CC=C2)C(=O)OC)C3=C(O1)C=C(C=C3)Cl)N

Isomeric SMILES

CCOC(=O)C1(/C(=C(/CC2=CC=CC=C2)\C(=O)OC)/C3=C(O1)C=C(C=C3)Cl)N

InChI

InChI=1S/C21H20ClNO5/c1-3-27-20(25)21(23)18(15-10-9-14(22)12-17(15)28-21)16(19(24)26-2)11-13-7-5-4-6-8-13/h4-10,12H,3,11,23H2,1-2H3/b18-16-