[6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-6-oxidanylidene-hexyl]azanium

Systemtic Name: [6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-6-oxidanylidene-hexyl]azanium Openeye Name: [6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-6-oxo-hexyl]ammonium CAS Name: [6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-6-oxohexyl]ammonium IUPAC Name: [6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-6-oxohexyl]azanium Traditional Name: [6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-6-keto-hexyl]ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CCCCC[NH3+])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CCCCC[NH3+])OC1

InChI

InChI=1S/C15H22N2O3/c16-8-3-1-2-5-15(18)17-12-6-7-13-14(11-12)20-10-4-9-19-13/h6-7,11H,1-5,8-10,16H2,(H,17,18)/p+1