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

Systemtic Name: (4-nitrophenyl)methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: 3-isopropoxypropyl-[(4-nitrophenyl)methyl]ammonium CAS Name: (4-nitrophenyl)methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: (4-nitrophenyl)methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: 3-isopropoxypropyl-(4-nitrobenzyl)ammonium Formula: C13H21N2O3+ MolecularWeight: 253.31744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O3/c1-11(2)18-9-3-8-14-10-12-4-6-13(7-5-12)15(16)17/h4-7,11,14H,3,8-10H2,1-2H3/p+1