[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-(phenylcarbonyl)amino] ethanoate

Systemtic Name: [(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-(phenylcarbonyl)amino] ethanoate Openeye Name: [benzoyl-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)amino] acetate CAS Name: acetic acid [benzoyl-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)amino] ester IUPAC Name: [benzoyl-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)amino] acetate Traditional Name: acetic acid [benzoyl-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)amino] ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON(C1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)ON(C1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O5/c1-13(24)28-23(20(26)15-7-5-4-6-8-15)18-16-11-14(12-22)9-10-17(16)27-21(2,3)19(18)25/h4-11,18-19,25H,1-3H3