[3-methyl-1-oxidanylidene-1-[[2-oxidanyl-1-phenoxy-3-(propan-2-ylamino)propyl]amino]butan-2-yl] nitrate

Systemtic Name: [3-methyl-1-oxidanylidene-1-[[2-oxidanyl-1-phenoxy-3-(propan-2-ylamino)propyl]amino]butan-2-yl] nitrate Openeye Name: [1-[[2-hydroxy-3-(isopropylamino)-1-phenoxy-propyl]carbamoyl]-2-methyl-propyl] nitrate CAS Name: nitric acid [1-[[2-hydroxy-1-phenoxy-3-(propan-2-ylamino)propyl]amino]-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-[[2-hydroxy-1-phenoxy-3-(propan-2-ylamino)propyl]amino]-3-methyl-1-oxobutan-2-yl] nitrate Traditional Name: nitric acid [1-[[2-hydroxy-3-(isopropylamino)-1-phenoxy-propyl]carbamoyl]-2-methyl-propyl] ester Formula: C17H27N3O6 MolecularWeight: 369.41278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C(CNC(C)C)O)OC1=CC=CC=C1)O[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)NC(C(CNC(C)C)O)OC1=CC=CC=C1)O[N+](=O)[O-]

InChI

InChI=1S/C17H27N3O6/c1-11(2)15(26-20(23)24)16(22)19-17(14(21)10-18-12(3)4)25-13-8-6-5-7-9-13/h5-9,11-12,14-15,17-18,21H,10H2,1-4H3,(H,19,22)