2-[4-nitro-2-(propylaminomethyl)phenoxy]ethanol

Systemtic Name: 2-[4-nitro-2-(propylaminomethyl)phenoxy]ethanol Openeye Name: 2-[4-nitro-2-(propylaminomethyl)phenoxy]ethanol CAS Name: 2-[4-nitro-2-(propylaminomethyl)phenoxy]ethanol IUPAC Name: 2-[4-nitro-2-(propylaminomethyl)phenoxy]ethanol Traditional Name: 2-[4-nitro-2-(propylaminomethyl)phenoxy]ethanol Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=C(C=CC(=C1)[N+](=O)[O-])OCCO

Isomeric SMILES

CCCNCC1=C(C=CC(=C1)[N+](=O)[O-])OCCO

InChI

InChI=1S/C12H18N2O4/c1-2-5-13-9-10-8-11(14(16)17)3-4-12(10)18-7-6-15/h3-4,8,13,15H,2,5-7,9H2,1H3