[1-nitrooxy-3-[[4-oxidanyl-3-phenoxy-5-(propan-2-ylamino)pentanoyl]amino]propan-2-yl] nitrate

Systemtic Name: [1-nitrooxy-3-[[4-oxidanyl-3-phenoxy-5-(propan-2-ylamino)pentanoyl]amino]propan-2-yl] nitrate Openeye Name: [1-[[[4-hydroxy-5-(isopropylamino)-3-phenoxy-pentanoyl]amino]methyl]-2-nitrooxy-ethyl] nitrate CAS Name: nitric acid [1-[[4-hydroxy-1-oxo-3-phenoxy-5-(propan-2-ylamino)pentyl]amino]-3-nitrooxypropan-2-yl] ester IUPAC Name: [1-[[4-hydroxy-3-phenoxy-5-(propan-2-ylamino)pentanoyl]amino]-3-nitrooxypropan-2-yl] nitrate Traditional Name: nitric acid [1-[[[4-hydroxy-5-(isopropylamino)-3-phenoxy-pentanoyl]amino]methyl]-2-nitrooxy-ethyl] ester Formula: C17H26N4O9 MolecularWeight: 430.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C(CC(=O)NCC(CO[N+](=O)[O-])O[N+](=O)[O-])OC1=CC=CC=C1)O

Isomeric SMILES

CC(C)NCC(C(CC(=O)NCC(CO[N+](=O)[O-])O[N+](=O)[O-])OC1=CC=CC=C1)O

InChI

InChI=1S/C17H26N4O9/c1-12(2)18-10-15(22)16(29-13-6-4-3-5-7-13)8-17(23)19-9-14(30-21(26)27)11-28-20(24)25/h3-7,12,14-16,18,22H,8-11H2,1-2H3,(H,19,23)