(3-nitrophenyl)methyl-(3-propan-2-yloxypropyl)azanium

Systemtic Name: (3-nitrophenyl)methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: 3-isopropoxypropyl-[(3-nitrophenyl)methyl]ammonium CAS Name: (3-nitrophenyl)methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: (3-nitrophenyl)methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: 3-isopropoxypropyl-(3-nitrobenzyl)ammonium Formula: C13H21N2O3+ MolecularWeight: 253.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCC[NH2+]CC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)OCCC[NH2+]CC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H20N2O3/c1-11(2)18-8-4-7-14-10-12-5-3-6-13(9-12)15(16)17/h3,5-6,9,11,14H,4,7-8,10H2,1-2H3/p+1