[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-oxidanylcyclohexyl)azanium

Systemtic Name: [(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-oxidanylcyclohexyl)azanium Openeye Name: [(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-hydroxycyclohexyl)ammonium CAS Name: [(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-hydroxycyclohexyl)ammonium IUPAC Name: [(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-hydroxycyclohexyl)azanium Traditional Name: [(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-hydroxycyclohexyl)ammonium Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)[NH2+]C3CCC(CC3)O

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCCCO2)[NH2+]C3CCC(CC3)O

InChI

InChI=1S/C17H25NO3/c1-12(18-14-4-6-15(19)7-5-14)13-3-8-16-17(11-13)21-10-2-9-20-16/h3,8,11-12,14-15,18-19H,2,4-7,9-10H2,1H3/p+1/t12-,14?,15?/m0/s1