methyl 4-[7-(2-morpholin-4-ylethanoylamino)-4-oxidanylidene-3-propyl-chromen-2-yl]benzoate

Systemtic Name: methyl 4-[7-(2-morpholin-4-ylethanoylamino)-4-oxidanylidene-3-propyl-chromen-2-yl]benzoate Openeye Name: methyl 4-[7-[(2-morpholinoacetyl)amino]-4-oxo-3-propyl-chromen-2-yl]benzoate CAS Name: 4-[7-[[2-(4-morpholinyl)-1-oxoethyl]amino]-4-oxo-3-propyl-1-benzopyran-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[7-[(2-morpholin-4-ylacetyl)amino]-4-oxo-3-propylchromen-2-yl]benzoate Traditional Name: 4-[4-keto-7-[(2-morpholinoacetyl)amino]-3-propyl-chromen-2-yl]benzoic acid methyl ester Formula: C26H28N2O6 MolecularWeight: 464.51032

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(OC2=C(C1=O)C=CC(=C2)NC(=O)CN3CCOCC3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CCCC1=C(OC2=C(C1=O)C=CC(=C2)NC(=O)CN3CCOCC3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H28N2O6/c1-3-4-21-24(30)20-10-9-19(27-23(29)16-28-11-13-33-14-12-28)15-22(20)34-25(21)17-5-7-18(8-6-17)26(31)32-2/h5-10,15H,3-4,11-14,16H2,1-2H3,(H,27,29)