[1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] 4-(nitrooxymethyl)benzoate

Systemtic Name: [1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] 4-(nitrooxymethyl)benzoate Openeye Name: [1-[(isopropylamino)methyl]-2-(1-naphthyloxy)ethyl] 4-(nitrooxymethyl)benzoate CAS Name: 4-(nitrooxymethyl)benzoic acid [1-(1-naphthalenyloxy)-3-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] 4-(nitrooxymethyl)benzoate Traditional Name: 4-(nitrooxymethyl)benzoic acid [1-[(isopropylamino)methyl]-2-(1-naphthoxy)ethyl] ester Formula: C24H26N2O6 MolecularWeight: 438.47304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=CC2=CC=CC=C21)OC(=O)C3=CC=C(C=C3)CO[N+](=O)[O-]

Isomeric SMILES

CC(C)NCC(COC1=CC=CC2=CC=CC=C21)OC(=O)C3=CC=C(C=C3)CO[N+](=O)[O-]

InChI

InChI=1S/C24H26N2O6/c1-17(2)25-14-21(16-30-23-9-5-7-19-6-3-4-8-22(19)23)32-24(27)20-12-10-18(11-13-20)15-31-26(28)29/h3-13,17,21,25H,14-16H2,1-2H3