3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]cyclohexan-1-ol

Systemtic Name: 3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]cyclohexan-1-ol Openeye Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]cyclohexanol CAS Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]-1-cyclohexanol IUPAC Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]cyclohexan-1-ol Traditional Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylamino]cyclohexanol Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)O)NCC2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

C1CC(CC(C1)O)NCC2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C16H22ClNO3/c17-14-7-11(8-15-16(14)21-6-2-5-20-15)10-18-12-3-1-4-13(19)9-12/h7-8,12-13,18-19H,1-6,9-10H2