[(S)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: [(S)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: [(S)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: [(S)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: [(S)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: [(S)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(C2=CC3=C(C=C2)OCCCO3)[NH3+]

Isomeric SMILES

C1C[C@@H](OC1)[C@H](C2=CC3=C(C=C2)OCCCO3)[NH3+]

InChI

InChI=1S/C14H19NO3/c15-14(12-3-1-6-17-12)10-4-5-11-13(9-10)18-8-2-7-16-11/h4-5,9,12,14H,1-3,6-8,15H2/p+1/t12-,14+/m1/s1