(4-nitrophenyl)methyl N-methyl-N-[(1-pyrrolidin-3-ylcarbonylpyrrolidin-1-ium-1-yl)methyl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-methyl-N-[(1-pyrrolidin-3-ylcarbonylpyrrolidin-1-ium-1-yl)methyl]carbamate Openeye Name: (4-nitrophenyl)methyl N-methyl-N-[[1-(pyrrolidine-3-carbonyl)pyrrolidin-1-ium-1-yl]methyl]carbamate CAS Name: N-methyl-N-[[1-[oxo(3-pyrrolidinyl)methyl]-1-pyrrolidin-1-iumyl]methyl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-methyl-N-[[1-(pyrrolidine-3-carbonyl)pyrrolidin-1-ium-1-yl]methyl]carbamate Traditional Name: N-methyl-N-[[1-(pyrrolidine-3-carbonyl)pyrrolidin-1-ium-1-yl]methyl]carbamic acid (4-nitrobenzyl) ester Formula: C19H27N4O5+ MolecularWeight: 391.44148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C[N+]1(CCCC1)C(=O)C2CCNC2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C[N+]1(CCCC1)C(=O)C2CCNC2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H27N4O5/c1-21(19(25)28-13-15-4-6-17(7-5-15)22(26)27)14-23(10-2-3-11-23)18(24)16-8-9-20-12-16/h4-7,16,20H,2-3,8-14H2,1H3/q+1