(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-(furan-2-ylcarbonylamino)-3-methyl-butanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: 2-(2-furoylamino)-3-methyl-butyric acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C22H22N2O7 MolecularWeight: 426.41928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C)NC(=O)C3=CC=CO3

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C)NC(=O)C3=CC=CO3

InChI

InChI=1S/C22H22N2O7/c1-12(2)20(24-21(27)17-5-4-8-29-17)22(28)30-11-14-9-19(26)31-18-10-15(23-13(3)25)6-7-16(14)18/h4-10,12,20H,11H2,1-3H3,(H,23,25)(H,24,27)