(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methylbutanoic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(4-tert-butylbenzoyl)amino]-3-methyl-butyric acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C28H32N2O6 MolecularWeight: 492.56348

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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=C(C=C3)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H32N2O6/c1-16(2)25(30-26(33)18-7-9-20(10-8-18)28(4,5)6)27(34)35-15-19-13-24(32)36-23-14-21(29-17(3)31)11-12-22(19)23/h7-14,16,25H,15H2,1-6H3,(H,29,31)(H,30,33)