methyl 1-(4-methyl-2-nitro-3-oxidanyl-phenyl)carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(4-methyl-2-nitro-3-oxidanyl-phenyl)carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(3-hydroxy-4-methyl-2-nitro-benzoyl)pyrrolidine-2-carboxylate CAS Name: 1-[(3-hydroxy-4-methyl-2-nitrophenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-hydroxy-4-methyl-2-nitrobenzoyl)pyrrolidine-2-carboxylate Traditional Name: 1-(3-hydroxy-4-methyl-2-nitro-benzoyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C14H16N2O6 MolecularWeight: 308.28664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)N2CCCC2C(=O)OC)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)N2CCCC2C(=O)OC)[N+](=O)[O-])O

InChI

InChI=1S/C14H16N2O6/c1-8-5-6-9(11(12(8)17)16(20)21)13(18)15-7-3-4-10(15)14(19)22-2/h5-6,10,17H,3-4,7H2,1-2H3