1-(3-methyl-4-nitro-phenoxy)-3-(propylamino)propan-2-ol

Systemtic Name: 1-(3-methyl-4-nitro-phenoxy)-3-(propylamino)propan-2-ol Openeye Name: 1-(3-methyl-4-nitro-phenoxy)-3-(propylamino)propan-2-ol CAS Name: 1-(3-methyl-4-nitrophenoxy)-3-(propylamino)-2-propanol IUPAC Name: 1-(3-methyl-4-nitrophenoxy)-3-(propylamino)propan-2-ol Traditional Name: 1-(3-methyl-4-nitro-phenoxy)-3-(propylamino)propan-2-ol Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC(COC1=CC(=C(C=C1)[N+](=O)[O-])C)O

Isomeric SMILES

CCCNCC(COC1=CC(=C(C=C1)[N+](=O)[O-])C)O

InChI

InChI=1S/C13H20N2O4/c1-3-6-14-8-11(16)9-19-12-4-5-13(15(17)18)10(2)7-12/h4-5,7,11,14,16H,3,6,8-9H2,1-2H3