[6-(3,3-dimethylbutanoylamino)-2-methyl-chromen-2-yl]methyl benzoate

Systemtic Name: [6-(3,3-dimethylbutanoylamino)-2-methyl-chromen-2-yl]methyl benzoate Openeye Name: [6-(3,3-dimethylbutanoylamino)-2-methyl-chromen-2-yl]methyl benzoate CAS Name: benzoic acid [6-[(3,3-dimethyl-1-oxobutyl)amino]-2-methyl-1-benzopyran-2-yl]methyl ester IUPAC Name: [6-(3,3-dimethylbutanoylamino)-2-methylchromen-2-yl]methyl benzoate Traditional Name: benzoic acid [6-(3,3-dimethylbutanoylamino)-2-methyl-chromen-2-yl]methyl ester Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C=CC(=C2)NC(=O)CC(C)(C)C)COC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1(C=CC2=C(O1)C=CC(=C2)NC(=O)CC(C)(C)C)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H27NO4/c1-23(2,3)15-21(26)25-19-10-11-20-18(14-19)12-13-24(4,29-20)16-28-22(27)17-8-6-5-7-9-17/h5-14H,15-16H2,1-4H3,(H,25,26)