[2-oxidanylidene-3-(prop-2-enylcarbamoyl)chromen-7-yl] 4-tert-butylbenzoate

Systemtic Name: [2-oxidanylidene-3-(prop-2-enylcarbamoyl)chromen-7-yl] 4-tert-butylbenzoate Openeye Name: [3-(allylcarbamoyl)-2-oxo-chromen-7-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [2-oxo-3-[oxo-(prop-2-enylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(prop-2-enylcarbamoyl)chromen-7-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [3-(allylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C24H23NO5 MolecularWeight: 405.44312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC=C

InChI

InChI=1S/C24H23NO5/c1-5-12-25-21(26)19-13-16-8-11-18(14-20(16)30-23(19)28)29-22(27)15-6-9-17(10-7-15)24(2,3)4/h5-11,13-14H,1,12H2,2-4H3,(H,25,26)