[3-(5-bromanyl-6-chloranyl-1-methyl-pyridin-1-ium-3-yl)-2-(propan-2-ylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-propan-2-ylcarbamate

Systemtic Name: [3-(5-bromanyl-6-chloranyl-1-methyl-pyridin-1-ium-3-yl)-2-(propan-2-ylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-propan-2-ylcarbamate Openeye Name: [3-(5-bromo-6-chloro-1-methyl-pyridin-1-ium-3-yl)-2-(isopropylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-isopropylcarbamate CAS Name: N-propan-2-ylcarbamic acid [3-(5-bromo-6-chloro-1-methyl-3-pyridin-1-iumyl)-2-[[oxo-(propan-2-ylamino)methoxy]methyl]-6,7-dihydro-5H-pyrrolizin-1-yl]methyl ester IUPAC Name: [3-(5-bromo-6-chloro-1-methylpyridin-1-ium-3-yl)-2-(propan-2-ylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-propan-2-ylcarbamate Traditional Name: N-isopropylcarbamic acid [3-(5-bromo-6-chloro-1-methyl-pyridin-1-ium-3-yl)-2-(isopropylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl ester Formula: C23H31BrClN4O4+ MolecularWeight: 542.87364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)OCC1=C2CCCN2C(=C1COC(=O)NC(C)C)C3=CC(=C([N+](=C3)C)Cl)Br

Isomeric SMILES

CC(C)NC(=O)OCC1=C2CCCN2C(=C1COC(=O)NC(C)C)C3=CC(=C([N+](=C3)C)Cl)Br

InChI

InChI=1S/C23H30BrClN4O4/c1-13(2)26-22(30)32-11-16-17(12-33-23(31)27-14(3)4)20(29-8-6-7-19(16)29)15-9-18(24)21(25)28(5)10-15/h9-10,13-14H,6-8,11-12H2,1-5H3,(H-,26,27,30,31)/p+1