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

Systemtic Name: 7-[[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-4-methyl-chromen-2-one Openeye Name: 7-[[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-oxo-ethyl]amino]-4-methyl-chromen-2-one CAS Name: 7-[[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-2-oxoethyl]amino]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-oxoethyl]amino]-4-methylchromen-2-one Traditional Name: 7-[[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-2-keto-ethyl]amino]-4-methyl-coumarin Formula: C25H26N2O5 MolecularWeight: 434.48434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NCC(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NCC(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C25H26N2O5/c1-16-12-25(29)32-22-14-18(6-7-19(16)22)26-15-24(28)27-9-2-4-20(27)17-5-8-21-23(13-17)31-11-3-10-30-21/h5-8,12-14,20,26H,2-4,9-11,15H2,1H3