(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-benzamidobutanoate

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-benzamidobutanoate Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CC(C)NC(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CC(C)NC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C23H23NO6/c1-3-15-10-18-17(11-22(27)30-20(18)12-19(15)25)13-29-21(26)9-14(2)24-23(28)16-7-5-4-6-8-16/h4-8,10-12,14,25H,3,9,13H2,1-2H3,(H,24,28)