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

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-tert-butylphenyl)carbonylamino]ethanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-[(4-tert-butylbenzoyl)amino]acetate CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]acetic 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]acetate Traditional Name: 2-[(4-tert-butylbenzoyl)amino]acetic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CNC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CNC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C25H26N2O6/c1-15(28)27-19-9-10-20-17(11-22(29)33-21(20)12-19)14-32-23(30)13-26-24(31)16-5-7-18(8-6-16)25(2,3)4/h5-12H,13-14H2,1-4H3,(H,26,31)(H,27,28)