(4-nitrophenyl)methyl N-[(1-methylpyrrolidin-1-ium-1-yl)methyl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[(1-methylpyrrolidin-1-ium-1-yl)methyl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[(1-methylpyrrolidin-1-ium-1-yl)methyl]carbamate CAS Name: N-[(1-methyl-1-pyrrolidin-1-iumyl)methyl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[(1-methylpyrrolidin-1-ium-1-yl)methyl]carbamate Traditional Name: N-[(1-methylpyrrolidin-1-ium-1-yl)methyl]carbamic acid (4-nitrobenzyl) ester Formula: C14H20N3O4+ MolecularWeight: 294.3263

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)CNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[N+]1(CCCC1)CNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O4/c1-17(8-2-3-9-17)11-15-14(18)21-10-12-4-6-13(7-5-12)16(19)20/h4-7H,2-3,8-11H2,1H3/p+1