(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-[(4-methoxybenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-[(4-methoxybenzoyl)amino]-3-methylbutanoate Traditional Name: 3-methyl-2-(p-anisoylamino)butyric acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C25H27NO6 MolecularWeight: 437.48498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C(C(C)C)NC(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C(C(C)C)NC(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C25H27NO6/c1-14(2)23(26-24(28)17-6-8-19(30-5)9-7-17)25(29)31-13-18-12-22(27)32-21-11-16(4)15(3)10-20(18)21/h6-12,14,23H,13H2,1-5H3,(H,26,28)