2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]carbonylchromen-4-one

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]carbonylchromen-4-one Openeye Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carbonyl]chromen-4-one CAS Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-oxomethyl]-1-benzopyran-4-one IUPAC Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carbonyl]chromen-4-one Traditional Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carbonyl]chromone Formula: C23H21NO5 MolecularWeight: 391.41654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC(=O)C3=CC=CC=C3O2)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC(=O)C3=CC=CC=C3O2)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C23H21NO5/c25-18-14-22(29-19-7-2-1-5-16(18)19)23(26)24-10-3-6-17(24)15-8-9-20-21(13-15)28-12-4-11-27-20/h1-2,5,7-9,13-14,17H,3-4,6,10-12H2