3-(4-nitrophenoxy)propyl-propan-2-yl-azanium

Systemtic Name: 3-(4-nitrophenoxy)propyl-propan-2-yl-azanium Openeye Name: isopropyl-[3-(4-nitrophenoxy)propyl]ammonium CAS Name: 3-(4-nitrophenoxy)propyl-propan-2-ylammonium IUPAC Name: 3-(4-nitrophenoxy)propyl-propan-2-ylazanium Traditional Name: isopropyl-[3-(4-nitrophenoxy)propyl]ammonium Formula: C12H19N2O3+ MolecularWeight: 239.29086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CCCOC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)[NH2+]CCCOC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O3/c1-10(2)13-8-3-9-17-12-6-4-11(5-7-12)14(15)16/h4-7,10,13H,3,8-9H2,1-2H3/p+1