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

Systemtic Name: ethyl 6-azanyl-5-cyano-4-[3-ethoxy-4-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-[3-ethoxy-4-[2-(3-methylanilino)-2-oxo-ethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-[3-ethoxy-4-[2-(3-methylanilino)-2-oxoethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-[3-ethoxy-4-[2-(3-methylanilino)-2-oxoethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-[3-ethoxy-4-[2-keto-2-(m-toluidino)ethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C27H29N3O6 MolecularWeight: 491.53566

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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=CC(=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O6/c1-5-33-22-13-18(25-20(14-28)26(29)36-17(4)24(25)27(32)34-6-2)10-11-21(22)35-15-23(31)30-19-9-7-8-16(3)12-19/h7-13,25H,5-6,15,29H2,1-4H3,(H,30,31)