ethyl 3-[(4-ethylphenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

InChI

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