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

Systemtic Name: pentyl 4-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]benzoate Openeye Name: pentyl 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 pentyl ester IUPAC Name: pentyl 4-[2-(4-methyl-2-oxochromen-7-yl)oxypropanoylamino]benzoate Traditional Name: 4-[2-(2-keto-4-methyl-chromen-7-yl)oxypropanoylamino]benzoic acid amyl ester Formula: C25H27NO6 MolecularWeight: 437.48498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27NO6/c1-4-5-6-13-30-25(29)18-7-9-19(10-8-18)26-24(28)17(3)31-20-11-12-21-16(2)14-23(27)32-22(21)15-20/h7-12,14-15,17H,4-6,13H2,1-3H3,(H,26,28)