hexyl 4-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]benzoate

Systemtic Name: hexyl 4-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]benzoate Openeye Name: hexyl 4-[2-(4-methyl-2-oxo-chromen-7-yl)oxypropanoylamino]benzoate CAS Name: 4-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[2-(4-methyl-2-oxochromen-7-yl)oxypropanoylamino]benzoate Traditional Name: 4-[2-(2-keto-4-methyl-chromen-7-yl)oxypropanoylamino]benzoic acid hexyl ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)OC2=CC3=C(C=C2)C(=CC(=O)O3)C

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)OC2=CC3=C(C=C2)C(=CC(=O)O3)C

InChI

InChI=1S/C26H29NO6/c1-4-5-6-7-14-31-26(30)19-8-10-20(11-9-19)27-25(29)18(3)32-21-12-13-22-17(2)15-24(28)33-23(22)16-21/h8-13,15-16,18H,4-7,14H2,1-3H3,(H,27,29)