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

Systemtic Name: [4-[[[4-oxidanyl-3-phenoxy-5-(propan-2-ylamino)pentanoyl]amino]methyl]cyclohexyl] nitrate Openeye Name: [4-[[[4-hydroxy-5-(isopropylamino)-3-phenoxy-pentanoyl]amino]methyl]cyclohexyl] nitrate CAS Name: nitric acid [4-[[[4-hydroxy-1-oxo-3-phenoxy-5-(propan-2-ylamino)pentyl]amino]methyl]cyclohexyl] ester IUPAC Name: [4-[[[4-hydroxy-3-phenoxy-5-(propan-2-ylamino)pentanoyl]amino]methyl]cyclohexyl] nitrate Traditional Name: nitric acid [4-[[[4-hydroxy-5-(isopropylamino)-3-phenoxy-pentanoyl]amino]methyl]cyclohexyl] ester Formula: C21H33N3O6 MolecularWeight: 423.50322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C(CC(=O)NCC1CCC(CC1)O[N+](=O)[O-])OC2=CC=CC=C2)O

Isomeric SMILES

CC(C)NCC(C(CC(=O)NCC1CCC(CC1)O[N+](=O)[O-])OC2=CC=CC=C2)O

InChI

InChI=1S/C21H33N3O6/c1-15(2)22-14-19(25)20(29-17-6-4-3-5-7-17)12-21(26)23-13-16-8-10-18(11-9-16)30-24(27)28/h3-7,15-16,18-20,22,25H,8-14H2,1-2H3,(H,23,26)