ethyl 3-[(2,4-dimethylphenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[(2,4-dimethylphenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[(2,4-dimethylphenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(2,4-dimethylphenyl)methyl-methylamino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[(2,4-dimethylphenyl)methyl-methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[(2,4-dimethylbenzyl)-methyl-carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(C)CC2=C(C=C(C=C2)C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(C)CC2=C(C=C(C=C2)C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O5/c1-5-27-20(24)17-9-16(10-18(11-17)22(25)26)19(23)21(4)12-15-7-6-13(2)8-14(15)3/h6-11H,5,12H2,1-4H3