ethyl 2-[4-(2-azanyl-3-cyano-5-oxidanylidene-4,6,7,8-tetrahydrochromen-4-yl)-2-bromanyl-6-methoxy-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-(2-azanyl-3-cyano-5-oxidanylidene-4,6,7,8-tetrahydrochromen-4-yl)-2-bromanyl-6-methoxy-phenoxy]ethanoate Openeye Name: ethyl 2-[4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl)-2-bromo-6-methoxy-phenoxy]acetate CAS Name: 2-[4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-4-yl)-2-bromo-6-methoxyphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl)-2-bromo-6-methoxyphenoxy]acetate Traditional Name: 2-[4-(2-amino-3-cyano-5-keto-4,6,7,8-tetrahydrochromen-4-yl)-2-bromo-6-methoxy-phenoxy]acetic acid ethyl ester Formula: C21H21BrN2O6 MolecularWeight: 477.30524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1Br)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)OC

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1Br)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)OC

InChI

InChI=1S/C21H21BrN2O6/c1-3-28-17(26)10-29-20-13(22)7-11(8-16(20)27-2)18-12(9-23)21(24)30-15-6-4-5-14(25)19(15)18/h7-8,18H,3-6,10,24H2,1-2H3