6-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2,2-dimethyl-3H-chromen-4-one

Systemtic Name: 6-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2,2-dimethyl-3H-chromen-4-one Openeye Name: 6-[2-(azepan-1-yl)-2-oxo-ethoxy]-2,2-dimethyl-chroman-4-one CAS Name: 6-[2-(1-azepanyl)-2-oxoethoxy]-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 6-[2-(azepan-1-yl)-2-oxoethoxy]-2,2-dimethyl-3H-chromen-4-one Traditional Name: 6-[2-(azepan-1-yl)-2-keto-ethoxy]-2,2-dimethyl-chroman-4-one Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(O1)C=CC(=C2)OCC(=O)N3CCCCCC3)C

Isomeric SMILES

CC1(CC(=O)C2=C(O1)C=CC(=C2)OCC(=O)N3CCCCCC3)C

InChI

InChI=1S/C19H25NO4/c1-19(2)12-16(21)15-11-14(7-8-17(15)24-19)23-13-18(22)20-9-5-3-4-6-10-20/h7-8,11H,3-6,9-10,12-13H2,1-2H3