(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3,5-diacetamidobenzoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3,5-diacetamidobenzoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 3,5-diacetamidobenzoate CAS Name: 3,5-diacetamidobenzoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 3,5-diacetamidobenzoate Traditional Name: 3,5-diacetamidobenzoic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=CC(=C3)NC(=O)C)NC(=O)C)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=CC(=C3)NC(=O)C)NC(=O)C)C(C)C

InChI

InChI=1S/C25H26N2O6/c1-13(2)21-11-22-18(9-24(30)33-23(22)6-14(21)3)12-32-25(31)17-7-19(26-15(4)28)10-20(8-17)27-16(5)29/h6-11,13H,12H2,1-5H3,(H,26,28)(H,27,29)