[5-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)-2,4-dimethyl-phenyl]methyl ethanoate

Systemtic Name: [5-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)-2,4-dimethyl-phenyl]methyl ethanoate Openeye Name: [5-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2,4-dimethyl-phenyl]methyl acetate CAS Name: acetic acid [5-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-4-yl)-2,4-dimethylphenyl]methyl ester IUPAC Name: [5-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2,4-dimethylphenyl]methyl acetate Traditional Name: acetic acid [5-(2-amino-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-4-yl)-2,4-dimethyl-benzyl] ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)COC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)COC(=O)C)C

InChI

InChI=1S/C23H26N2O4/c1-12-6-13(2)16(7-15(12)11-28-14(3)26)20-17(10-24)22(25)29-19-9-23(4,5)8-18(27)21(19)20/h6-7,20H,8-9,11,25H2,1-5H3