methyl 2-methyl-3-(4-nitrophenyl)propanoate

Systemtic Name: methyl 2-methyl-3-(4-nitrophenyl)propanoate Openeye Name: methyl 2-methyl-3-(4-nitrophenyl)propanoate CAS Name: 2-methyl-3-(4-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-methyl-3-(4-nitrophenyl)propanoate Traditional Name: 2-methyl-3-(4-nitrophenyl)propionic acid methyl ester Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4/c1-8(11(13)16-2)7-9-3-5-10(6-4-9)12(14)15/h3-6,8H,7H2,1-2H3