(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl-[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-azanium

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl-[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-[2-(ethoxycarbonylamino)-2-oxo-ethyl]-ethyl-ammonium CAS Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-[2-(ethoxycarbonylamino)-2-oxoethyl]-ethylammonium IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-[2-(ethoxycarbonylamino)-2-oxoethyl]-ethylazanium Traditional Name: [2-(carbethoxyamino)-2-keto-ethyl]-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-ethyl-ammonium Formula: C16H22ClN2O5+ MolecularWeight: 357.80928

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=C2C(=CC(=C1)Cl)COCO2)CC(=O)NC(=O)OCC

Isomeric SMILES

CC[NH+](CC1=C2C(=CC(=C1)Cl)COCO2)CC(=O)NC(=O)OCC

InChI

InChI=1S/C16H21ClN2O5/c1-3-19(8-14(20)18-16(21)23-4-2)7-11-5-13(17)6-12-9-22-10-24-15(11)12/h5-6H,3-4,7-10H2,1-2H3,(H,18,20,21)/p+1