[1-(3-methylphenoxy)-3-(propan-2-ylamino)propan-2-yl] nitrate

Systemtic Name: [1-(3-methylphenoxy)-3-(propan-2-ylamino)propan-2-yl] nitrate Openeye Name: [1-[(isopropylamino)methyl]-2-(3-methylphenoxy)ethyl] nitrate CAS Name: nitric acid [1-(3-methylphenoxy)-3-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-(3-methylphenoxy)-3-(propan-2-ylamino)propan-2-yl] nitrate Traditional Name: nitric acid [1-[(isopropylamino)methyl]-2-(3-methylphenoxy)ethyl] ester Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CNC(C)C)O[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCC(CNC(C)C)O[N+](=O)[O-]

InChI

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