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

Systemtic Name: ethyl 2-azanyl-4-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate Openeye Name: ethyl 2-amino-4-(3-bromo-5-ethoxy-4-methoxy-phenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate CAS Name: 2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate Traditional Name: 2-amino-4-(3-bromo-5-ethoxy-4-methoxy-phenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carboxylic acid ethyl ester Formula: C23H28BrNO6 MolecularWeight: 494.37552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)(C)C)OC(=C2C(=O)OCC)N)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)(C)C)OC(=C2C(=O)OCC)N)Br)OC

InChI

InChI=1S/C23H28BrNO6/c1-6-29-15-9-12(8-13(24)20(15)28-5)17-18-14(26)10-23(3,4)11-16(18)31-21(25)19(17)22(27)30-7-2/h8-9,17H,6-7,10-11,25H2,1-5H3