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

Systemtic Name: [2-[[4-oxidanyl-3-phenoxy-5-(propan-2-ylamino)pentanoyl]amino]cyclohexyl] nitrate Openeye Name: [2-[[4-hydroxy-5-(isopropylamino)-3-phenoxy-pentanoyl]amino]cyclohexyl] nitrate CAS Name: nitric acid [2-[[4-hydroxy-1-oxo-3-phenoxy-5-(propan-2-ylamino)pentyl]amino]cyclohexyl] ester IUPAC Name: [2-[[4-hydroxy-3-phenoxy-5-(propan-2-ylamino)pentanoyl]amino]cyclohexyl] nitrate Traditional Name: nitric acid [2-[[4-hydroxy-5-(isopropylamino)-3-phenoxy-pentanoyl]amino]cyclohexyl] ester Formula: C20H31N3O6 MolecularWeight: 409.47664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C(CC(=O)NC1CCCCC1O[N+](=O)[O-])OC2=CC=CC=C2)O

Isomeric SMILES

CC(C)NCC(C(CC(=O)NC1CCCCC1O[N+](=O)[O-])OC2=CC=CC=C2)O

InChI

InChI=1S/C20H31N3O6/c1-14(2)21-13-17(24)19(28-15-8-4-3-5-9-15)12-20(25)22-16-10-6-7-11-18(16)29-23(26)27/h3-5,8-9,14,16-19,21,24H,6-7,10-13H2,1-2H3,(H,22,25)