[2-oxidanylidene-3-(propan-2-ylcarbamoyl)chromen-7-yl] 3,4-dimethylbenzoate

Systemtic Name: [2-oxidanylidene-3-(propan-2-ylcarbamoyl)chromen-7-yl] 3,4-dimethylbenzoate Openeye Name: [3-(isopropylcarbamoyl)-2-oxo-chromen-7-yl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-oxo-3-[oxo-(propan-2-ylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(propan-2-ylcarbamoyl)chromen-7-yl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [3-(isopropylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC(C)C)C

InChI

InChI=1S/C22H21NO5/c1-12(2)23-20(24)18-10-15-7-8-17(11-19(15)28-22(18)26)27-21(25)16-6-5-13(3)14(4)9-16/h5-12H,1-4H3,(H,23,24)