[2-[(2,2-dimethyl-3-nitrooxy-propanoyl)carbamoyl]phenyl] 2,2-dimethyl-3-nitrooxy-propanoate

Systemtic Name: [2-[(2,2-dimethyl-3-nitrooxy-propanoyl)carbamoyl]phenyl] 2,2-dimethyl-3-nitrooxy-propanoate Openeye Name: [2-[(2,2-dimethyl-3-nitrooxy-propanoyl)carbamoyl]phenyl] 2,2-dimethyl-3-nitrooxy-propanoate CAS Name: 2,2-dimethyl-3-nitrooxypropanoic acid [2-[[(2,2-dimethyl-3-nitrooxy-1-oxopropyl)amino]-oxomethyl]phenyl] ester IUPAC Name: [2-[(2,2-dimethyl-3-nitrooxypropanoyl)carbamoyl]phenyl] 2,2-dimethyl-3-nitrooxypropanoate Traditional Name: 2,2-dimethyl-3-nitrooxy-propionic acid [2-[(2,2-dimethyl-3-nitrooxy-propanoyl)carbamoyl]phenyl] ester Formula: C17H21N3O10 MolecularWeight: 427.36274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO[N+](=O)[O-])C(=O)NC(=O)C1=CC=CC=C1OC(=O)C(C)(C)CO[N+](=O)[O-]

Isomeric SMILES

CC(C)(CO[N+](=O)[O-])C(=O)NC(=O)C1=CC=CC=C1OC(=O)C(C)(C)CO[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O10/c1-16(2,9-28-19(24)25)14(22)18-13(21)11-7-5-6-8-12(11)30-15(23)17(3,4)10-29-20(26)27/h5-8H,9-10H2,1-4H3,(H,18,21,22)