(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[cyclohexyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 2-(cyclohexanecarbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C27H29NO7 MolecularWeight: 479.52166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=C(C=C3NC(=O)C4CCCCC4)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=C(C=C3NC(=O)C4CCCCC4)OC)OC

InChI

InChI=1S/C27H29NO7/c1-16-9-10-19-18(12-25(29)35-22(19)11-16)15-34-27(31)20-13-23(32-2)24(33-3)14-21(20)28-26(30)17-7-5-4-6-8-17/h9-14,17H,4-8,15H2,1-3H3,(H,28,30)