7-nitrooxyheptyl 2-[4-(4-chlorophenyl)carbonylphenoxy]-2-methyl-propanoate

Systemtic Name: 7-nitrooxyheptyl 2-[4-(4-chlorophenyl)carbonylphenoxy]-2-methyl-propanoate Openeye Name: 7-nitrooxyheptyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-propanoate CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]phenoxy]-2-methylpropanoic acid 7-nitrooxyheptyl ester IUPAC Name: 7-nitrooxyheptyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate Traditional Name: 2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-propionic acid 7-nitrooxyheptyl ester Formula: C24H28ClNO7 MolecularWeight: 477.93462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28ClNO7/c1-24(2,23(28)31-16-6-4-3-5-7-17-32-26(29)30)33-21-14-10-19(11-15-21)22(27)18-8-12-20(25)13-9-18/h8-15H,3-7,16-17H2,1-2H3