[2-methyl-6-(pentanoylamino)chromen-2-yl]methyl benzoate

Systemtic Name: [2-methyl-6-(pentanoylamino)chromen-2-yl]methyl benzoate Openeye Name: [2-methyl-6-(pentanoylamino)chromen-2-yl]methyl benzoate CAS Name: benzoic acid [2-methyl-6-(1-oxopentylamino)-1-benzopyran-2-yl]methyl ester IUPAC Name: [2-methyl-6-(pentanoylamino)chromen-2-yl]methyl benzoate Traditional Name: benzoic acid [2-methyl-6-(valerylamino)chromen-2-yl]methyl ester Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC2=C(C=C1)OC(C=C2)(C)COC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC(=O)NC1=CC2=C(C=C1)OC(C=C2)(C)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H25NO4/c1-3-4-10-21(25)24-19-11-12-20-18(15-19)13-14-23(2,28-20)16-27-22(26)17-8-6-5-7-9-17/h5-9,11-15H,3-4,10,16H2,1-2H3,(H,24,25)