4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C24H25NO5 MolecularWeight: 407.459

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CN3CCCC3C4=CC5=C(C=C4)OCCCO5)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CN3CCCC3C4=CC5=C(C=C4)OCCCO5)O

InChI

InChI=1S/C24H25NO5/c1-15-20(26)7-6-18-17(13-23(27)30-24(15)18)14-25-9-2-4-19(25)16-5-8-21-22(12-16)29-11-3-10-28-21/h5-8,12-13,19,26H,2-4,9-11,14H2,1H3