ethyl 6-azanyl-4-[4-[2-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-[4-[2-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-[4-[2-(4-bromo-2,6-dimethyl-anilino)-2-oxo-ethoxy]-3-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-[4-[2-(4-bromo-2,6-dimethylanilino)-2-oxoethoxy]-3-methoxyphenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-[4-[2-(4-bromo-2,6-dimethylanilino)-2-oxoethoxy]-3-methoxyphenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-[4-[2-(4-bromo-2,6-dimethyl-anilino)-2-keto-ethoxy]-3-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C27H28BrN3O6 MolecularWeight: 570.43172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2)OCC(=O)NC3=C(C=C(C=C3C)Br)C)OC)C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2)OCC(=O)NC3=C(C=C(C=C3C)Br)C)OC)C#N)N)C

InChI

InChI=1S/C27H28BrN3O6/c1-6-35-27(33)23-16(4)37-26(30)19(12-29)24(23)17-7-8-20(21(11-17)34-5)36-13-22(32)31-25-14(2)9-18(28)10-15(25)3/h7-11,24H,6,13,30H2,1-5H3,(H,31,32)