[1-(1H-indol-4-yloxy)-3-(propan-2-ylamino)propan-2-yl] 2-(2-nitrooxyethoxy)ethanoate

Systemtic Name: [1-(1H-indol-4-yloxy)-3-(propan-2-ylamino)propan-2-yl] 2-(2-nitrooxyethoxy)ethanoate Openeye Name: [1-(1H-indol-4-yloxymethyl)-2-(isopropylamino)ethyl] 2-(2-nitrooxyethoxy)acetate CAS Name: 2-(2-nitrooxyethoxy)acetic acid [1-(1H-indol-4-yloxy)-3-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-(1H-indol-4-yloxy)-3-(propan-2-ylamino)propan-2-yl] 2-(2-nitrooxyethoxy)acetate Traditional Name: 2-(2-nitrooxyethoxy)acetic acid [1-(1H-indol-4-yloxymethyl)-2-(isopropylamino)ethyl] ester Formula: C18H25N3O7 MolecularWeight: 395.407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=CC2=C1C=CN2)OC(=O)COCCO[N+](=O)[O-]

Isomeric SMILES

CC(C)NCC(COC1=CC=CC2=C1C=CN2)OC(=O)COCCO[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O7/c1-13(2)20-10-14(28-18(22)12-25-8-9-27-21(23)24)11-26-17-5-3-4-16-15(17)6-7-19-16/h3-7,13-14,19-20H,8-12H2,1-2H3