6-[[2-[4-(4-chlorophenyl)carbonylphenoxy]-2-methyl-propanoyl]amino]hexyl nitrate

Systemtic Name: 6-[[2-[4-(4-chlorophenyl)carbonylphenoxy]-2-methyl-propanoyl]amino]hexyl nitrate Openeye Name: 6-[[2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-propanoyl]amino]hexyl nitrate CAS Name: nitric acid 6-[[2-[4-[(4-chlorophenyl)-oxomethyl]phenoxy]-2-methyl-1-oxopropyl]amino]hexyl ester IUPAC Name: 6-[[2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoyl]amino]hexyl nitrate Traditional Name: nitric acid 6-[[2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-propanoyl]amino]hexyl ester Formula: C23H27ClN2O6 MolecularWeight: 462.92328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NCCCCCCO[N+](=O)[O-])OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C(=O)NCCCCCCO[N+](=O)[O-])OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C23H27ClN2O6/c1-23(2,22(28)25-15-5-3-4-6-16-31-26(29)30)32-20-13-9-18(10-14-20)21(27)17-7-11-19(24)12-8-17/h7-14H,3-6,15-16H2,1-2H3,(H,25,28)