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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C(CC(=O)N1CCCC(C1)CO[N+](=O)[O-])OC2=CC=CC=C2)O

Isomeric SMILES

CC(C)NCC(C(CC(=O)N1CCCC(C1)CO[N+](=O)[O-])OC2=CC=CC=C2)O

InChI

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