methyl 2-azanyl-4-(5-bromanyl-2-ethoxy-phenyl)-7-(dimethylamino)-4H-chromene-3-carboxylate

Systemtic Name: methyl 2-azanyl-4-(5-bromanyl-2-ethoxy-phenyl)-7-(dimethylamino)-4H-chromene-3-carboxylate Openeye Name: methyl 2-amino-4-(5-bromo-2-ethoxy-phenyl)-7-(dimethylamino)-4H-chromene-3-carboxylate CAS Name: 2-amino-4-(5-bromo-2-ethoxyphenyl)-7-(dimethylamino)-4H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(5-bromo-2-ethoxyphenyl)-7-(dimethylamino)-4H-chromene-3-carboxylate Traditional Name: 2-amino-4-(5-bromo-2-ethoxy-phenyl)-7-(dimethylamino)-4H-chromene-3-carboxylic acid methyl ester Formula: C21H23BrN2O4 MolecularWeight: 447.32232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C2C3=C(C=C(C=C3)N(C)C)OC(=C2C(=O)OC)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C2C3=C(C=C(C=C3)N(C)C)OC(=C2C(=O)OC)N

InChI

InChI=1S/C21H23BrN2O4/c1-5-27-16-9-6-12(22)10-15(16)18-14-8-7-13(24(2)3)11-17(14)28-20(23)19(18)21(25)26-4/h6-11,18H,5,23H2,1-4H3