[5-[2-[[3-(2-cyclopentylphenoxy)-2-oxidanyl-propyl]amino]ethylamino]-5-oxidanylidene-pentyl] nitrate

Systemtic Name: [5-[2-[[3-(2-cyclopentylphenoxy)-2-oxidanyl-propyl]amino]ethylamino]-5-oxidanylidene-pentyl] nitrate Openeye Name: [5-[2-[[3-(2-cyclopentylphenoxy)-2-hydroxy-propyl]amino]ethylamino]-5-oxo-pentyl] nitrate CAS Name: nitric acid [5-[2-[[3-(2-cyclopentylphenoxy)-2-hydroxypropyl]amino]ethylamino]-5-oxopentyl] ester IUPAC Name: [5-[2-[[3-(2-cyclopentylphenoxy)-2-hydroxypropyl]amino]ethylamino]-5-oxopentyl] nitrate Traditional Name: nitric acid [5-[2-[[3-(2-cyclopentylphenoxy)-2-hydroxy-propyl]amino]ethylamino]-5-keto-pentyl] ester Formula: C21H33N3O6 MolecularWeight: 423.50322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=CC=CC=C2OCC(CNCCNC(=O)CCCCO[N+](=O)[O-])O

Isomeric SMILES

C1CCC(C1)C2=CC=CC=C2OCC(CNCCNC(=O)CCCCO[N+](=O)[O-])O

InChI

InChI=1S/C21H33N3O6/c25-18(15-22-12-13-23-21(26)11-5-6-14-30-24(27)28)16-29-20-10-4-3-9-19(20)17-7-1-2-8-17/h3-4,9-10,17-18,22,25H,1-2,5-8,11-16H2,(H,23,26)