3-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)azepan-2-one

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)azepan-2-one Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)azepan-2-one CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)-2-azepanone IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)azepan-2-one Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)azepan-2-one Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=C3C(=CC=C2)OCCCO3

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=C3C(=CC=C2)OCCCO3

InChI

InChI=1S/C16H22N2O3/c19-16-13(6-1-2-8-17-16)18-11-12-5-3-7-14-15(12)21-10-4-9-20-14/h3,5,7,13,18H,1-2,4,6,8-11H2,(H,17,19)