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

Systemtic Name: 4,8-dimethyl-6-[(3-morpholin-4-ylpropylamino)methyl]-7-oxidanyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-7-hydroxy-4,8-dimethyl-6-[(3-morpholinopropylamino)methyl]chromen-2-one CAS Name: 7-hydroxy-4,8-dimethyl-6-[[3-(4-morpholinyl)propylamino]methyl]-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-7-hydroxy-4,8-dimethyl-6-[(3-morpholin-4-ylpropylamino)methyl]chromen-2-one Traditional Name: 3-benzyl-7-hydroxy-4,8-dimethyl-6-[(3-morpholinopropylamino)methyl]coumarin Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)CNCCCN3CCOCC3)O)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)CNCCCN3CCOCC3)O)C)CC4=CC=CC=C4

InChI

InChI=1S/C26H32N2O4/c1-18-22-16-21(17-27-9-6-10-28-11-13-31-14-12-28)24(29)19(2)25(22)32-26(30)23(18)15-20-7-4-3-5-8-20/h3-5,7-8,16,27,29H,6,9-15,17H2,1-2H3