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

Systemtic Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-methylcyclohexyl)azanium Openeye Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-methylcyclohexyl)ammonium CAS Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-methylcyclohexyl)ammonium IUPAC Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-methylcyclohexyl)azanium Traditional Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-(4-methylcyclohexyl)ammonium Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)[NH2+]C(C)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1CCC(CC1)[NH2+][C@H](C)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H27NO2/c1-13-4-7-16(8-5-13)19-14(2)15-6-9-17-18(12-15)21-11-3-10-20-17/h6,9,12-14,16,19H,3-5,7-8,10-11H2,1-2H3/p+1/t13?,14-,16?/m1/s1