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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-8-(morpholin-4-ylmethyl)-7-oxidanyl-chromen-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-8-(morpholinomethyl)chromen-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-8-(4-morpholinylmethyl)-1-benzopyran-2-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-8-(morpholin-4-ylmethyl)chromen-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-8-(morpholinomethyl)coumarin Formula: C21H19NO6 MolecularWeight: 381.37866

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=C(C=CC3=C2OC(=O)C(=C3)C4=CC5=C(C=C4)OCO5)O

Isomeric SMILES

C1COCCN1CC2=C(C=CC3=C2OC(=O)C(=C3)C4=CC5=C(C=C4)OCO5)O

InChI

InChI=1S/C21H19NO6/c23-17-3-1-14-9-15(13-2-4-18-19(10-13)27-12-26-18)21(24)28-20(14)16(17)11-22-5-7-25-8-6-22/h1-4,9-10,23H,5-8,11-12H2