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

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-[(4-methoxybenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-methoxyphenyl)-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-methoxybenzoyl)amino]-3-methylbutanoate Traditional Name: 3-methyl-2-(p-anisoylamino)butyric acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C25H26N2O7 MolecularWeight: 466.48314

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H26N2O7/c1-14(2)23(27-24(30)16-5-8-19(32-4)9-6-16)25(31)33-13-17-11-22(29)34-21-12-18(26-15(3)28)7-10-20(17)21/h5-12,14,23H,13H2,1-4H3,(H,26,28)(H,27,30)