1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(4-methylpiperidin-1-yl)butane-1,4-dione

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(4-methylpiperidin-1-yl)butane-1,4-dione Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(4-methyl-1-piperidyl)butane-1,4-dione CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(4-methyl-1-piperidinyl)butane-1,4-dione IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(4-methylpiperidin-1-yl)butane-1,4-dione Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(4-methylpiperidino)butane-1,4-dione Formula: C19H25NO4 MolecularWeight: 331.4061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1CCN(CC1)C(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H25NO4/c1-14-7-9-20(10-8-14)19(22)6-4-16(21)15-3-5-17-18(13-15)24-12-2-11-23-17/h3,5,13-14H,2,4,6-12H2,1H3