(1R)-N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-pyridin-2-yl-ethanamine

Systemtic Name: (1R)-N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-pyridin-2-yl-ethanamine Openeye Name: (1R)-N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-(2-pyridyl)ethanamine CAS Name: (1R)-N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-(2-pyridinyl)ethanamine IUPAC Name: (1R)-N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-pyridin-2-ylethanamine Traditional Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-[(1R)-1-(2-pyridyl)ethyl]amine Formula: C17H19ClN2O2 MolecularWeight: 318.79796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)NCC2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

C[C@H](C1=CC=CC=N1)NCC2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C17H19ClN2O2/c1-12(15-5-2-3-6-19-15)20-11-13-9-14(18)17-16(10-13)21-7-4-8-22-17/h2-3,5-6,9-10,12,20H,4,7-8,11H2,1H3/t12-/m1/s1