(3-methyl-4-nitro-phenyl) (2R)-2-(3-methylphenoxy)propanoate

Systemtic Name: (3-methyl-4-nitro-phenyl) (2R)-2-(3-methylphenoxy)propanoate Openeye Name: (3-methyl-4-nitro-phenyl) (2R)-2-(3-methylphenoxy)propanoate CAS Name: (2R)-2-(3-methylphenoxy)propanoic acid (3-methyl-4-nitrophenyl) ester IUPAC Name: (3-methyl-4-nitrophenyl) (2R)-2-(3-methylphenoxy)propanoate Traditional Name: (2R)-2-(3-methylphenoxy)propionic acid (3-methyl-4-nitro-phenyl) ester Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(C)C(=O)OC2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC=C1)O[C@H](C)C(=O)OC2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H17NO5/c1-11-5-4-6-14(9-11)22-13(3)17(19)23-15-7-8-16(18(20)21)12(2)10-15/h4-10,13H,1-3H3/t13-/m1/s1