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

Systemtic Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxidanylidene-propyl]azanium Openeye Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxo-propyl]ammonium CAS Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxopropyl]ammonium IUPAC Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-oxopropyl]azanium Traditional Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-keto-propyl]ammonium Formula: C12H17N2O3+ MolecularWeight: 237.27498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3/c13-5-4-12(15)14-9-2-3-10-11(8-9)17-7-1-6-16-10/h2-3,8H,1,4-7,13H2,(H,14,15)/p+1