[1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] 2-(2-nitrooxyethoxy)ethanoate

Systemtic Name: [1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] 2-(2-nitrooxyethoxy)ethanoate Openeye Name: [1-[(isopropylamino)methyl]-2-(1-naphthyloxy)ethyl] 2-(2-nitrooxyethoxy)acetate CAS Name: 2-(2-nitrooxyethoxy)acetic 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] 2-(2-nitrooxyethoxy)acetate Traditional Name: 2-(2-nitrooxyethoxy)acetic acid [1-[(isopropylamino)methyl]-2-(1-naphthoxy)ethyl] ester Formula: C20H26N2O7 MolecularWeight: 406.42964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O7/c1-15(2)21-12-17(29-20(23)14-26-10-11-28-22(24)25)13-27-19-9-5-7-16-6-3-4-8-18(16)19/h3-9,15,17,21H,10-14H2,1-2H3