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

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-[2-(isopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-[2-(isopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C15H22ClN2O3+ MolecularWeight: 313.79978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21ClN2O3/c1-10(2)17-14(19)7-18(3)6-11-4-13(16)5-12-8-20-9-21-15(11)12/h4-5,10H,6-9H2,1-3H3,(H,17,19)/p+1