(4-nitrophenyl)methyl N-(4-azanylbutyl)carbamate

Systemtic Name: (4-nitrophenyl)methyl N-(4-azanylbutyl)carbamate Openeye Name: (4-nitrophenyl)methyl N-(4-aminobutyl)carbamate CAS Name: N-(4-aminobutyl)carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(4-aminobutyl)carbamate Traditional Name: N-(4-aminobutyl)carbamic acid (4-nitrobenzyl) ester Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)NCCCCN)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)NCCCCN)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O4/c13-7-1-2-8-14-12(16)19-9-10-3-5-11(6-4-10)15(17)18/h3-6H,1-2,7-9,13H2,(H,14,16)