4,8-dimethyl-6-[(2-morpholin-4-ylethylamino)methyl]-7-oxidanyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 4,8-dimethyl-6-[(2-morpholin-4-ylethylamino)methyl]-7-oxidanyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-7-hydroxy-4,8-dimethyl-6-[(2-morpholinoethylamino)methyl]chromen-2-one CAS Name: 7-hydroxy-4,8-dimethyl-6-[[2-(4-morpholinyl)ethylamino]methyl]-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-7-hydroxy-4,8-dimethyl-6-[(2-morpholin-4-ylethylamino)methyl]chromen-2-one Traditional Name: 3-benzyl-7-hydroxy-4,8-dimethyl-6-[(2-morpholinoethylamino)methyl]coumarin Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)CNCCN3CCOCC3)O)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)CNCCN3CCOCC3)O)C)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N2O4/c1-17-21-15-20(16-26-8-9-27-10-12-30-13-11-27)23(28)18(2)24(21)31-25(29)22(17)14-19-6-4-3-5-7-19/h3-7,15,26,28H,8-14,16H2,1-2H3