3-oxidanylpropyl 3-(5-chloranyl-2-nitro-phenyl)-2-methyl-propanoate

Systemtic Name: 3-oxidanylpropyl 3-(5-chloranyl-2-nitro-phenyl)-2-methyl-propanoate Openeye Name: 3-hydroxypropyl 3-(5-chloro-2-nitro-phenyl)-2-methyl-propanoate CAS Name: 3-(5-chloro-2-nitrophenyl)-2-methylpropanoic acid 3-hydroxypropyl ester IUPAC Name: 3-hydroxypropyl 3-(5-chloro-2-nitrophenyl)-2-methylpropanoate Traditional Name: 3-(5-chloro-2-nitro-phenyl)-2-methyl-propionic acid 3-hydroxypropyl ester Formula: C13H16ClNO5 MolecularWeight: 301.72284

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C=CC(=C1)Cl)[N+](=O)[O-])C(=O)OCCCO

Isomeric SMILES

CC(CC1=C(C=CC(=C1)Cl)[N+](=O)[O-])C(=O)OCCCO

InChI

InChI=1S/C13H16ClNO5/c1-9(13(17)20-6-2-5-16)7-10-8-11(14)3-4-12(10)15(18)19/h3-4,8-9,16H,2,5-7H2,1H3