3-(1,3-benzodioxol-5-yl)-4-methyl-8-(morpholin-4-ylmethyl)-7-oxidanyl-chromen-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-8-(morpholin-4-ylmethyl)-7-oxidanyl-chromen-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-methyl-8-(morpholinomethyl)chromen-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-methyl-8-(4-morpholinylmethyl)-1-benzopyran-2-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-methyl-8-(morpholin-4-ylmethyl)chromen-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-methyl-8-(morpholinomethyl)coumarin Formula: C22H21NO6 MolecularWeight: 395.40524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2CN3CCOCC3)O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2CN3CCOCC3)O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21NO6/c1-13-15-3-4-17(24)16(11-23-6-8-26-9-7-23)21(15)29-22(25)20(13)14-2-5-18-19(10-14)28-12-27-18/h2-5,10,24H,6-9,11-12H2,1H3