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

Systemtic Name: ethyl 6-azanyl-4-[4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-[4-[2-(4-bromo-3-methyl-anilino)-2-oxo-ethoxy]-3-ethoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-[4-[2-(4-bromo-3-methylanilino)-2-oxoethoxy]-3-ethoxyphenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-[4-[2-(4-bromo-3-methylanilino)-2-oxoethoxy]-3-ethoxyphenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-[4-[2-(4-bromo-3-methyl-anilino)-2-keto-ethoxy]-3-ethoxy-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:

CCOC1=C(C=CC(=C1)C2C(=C(OC(=C2C(=O)OCC)C)N)C#N)OCC(=O)NC3=CC(=C(C=C3)Br)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(OC(=C2C(=O)OCC)C)N)C#N)OCC(=O)NC3=CC(=C(C=C3)Br)C

InChI

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