ethyl 2-azanyl-4-[3,5-bis(bromanyl)-2-methoxy-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[3,5-bis(bromanyl)-2-methoxy-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate Openeye Name: ethyl 2-amino-4-(3,5-dibromo-2-methoxy-phenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate CAS Name: 2-amino-4-(3,5-dibromo-2-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(3,5-dibromo-2-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate Traditional Name: 2-amino-4-(3,5-dibromo-2-methoxy-phenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carboxylic acid ethyl ester Formula: C21H23Br2NO5 MolecularWeight: 529.21902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC(=CC(=C3OC)Br)Br)C(=O)CC(C2)(C)C)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=CC(=CC(=C3OC)Br)Br)C(=O)CC(C2)(C)C)N

InChI

InChI=1S/C21H23Br2NO5/c1-5-28-20(26)17-15(11-6-10(22)7-12(23)18(11)27-4)16-13(25)8-21(2,3)9-14(16)29-19(17)24/h6-7,15H,5,8-9,24H2,1-4H3