(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-azanyl-3,5-bis(chloranyl)benzoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-azanyl-3,5-bis(chloranyl)benzoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 2-amino-3,5-dichloro-benzoate CAS Name: 2-amino-3,5-dichlorobenzoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 2-amino-3,5-dichlorobenzoate Traditional Name: 2-amino-3,5-dichloro-benzoic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H19Cl2NO4 MolecularWeight: 420.28586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=CC(=C3N)Cl)Cl)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=CC(=C3N)Cl)Cl)C(C)C

InChI

InChI=1S/C21H19Cl2NO4/c1-10(2)14-8-15-12(5-19(25)28-18(15)4-11(14)3)9-27-21(26)16-6-13(22)7-17(23)20(16)24/h4-8,10H,9,24H2,1-3H3