methyl 4-[2-[(2-methyl-3-nitro-phenyl)carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[(2-methyl-3-nitro-phenyl)carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[(2-methyl-3-nitro-benzoyl)amino]ethyl]benzoate CAS Name: 4-[2-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(2-methyl-3-nitrobenzoyl)amino]ethyl]benzoate Traditional Name: 4-[2-[(2-methyl-3-nitro-benzoyl)amino]ethyl]benzoic acid methyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H18N2O5/c1-12-15(4-3-5-16(12)20(23)24)17(21)19-11-10-13-6-8-14(9-7-13)18(22)25-2/h3-9H,10-11H2,1-2H3,(H,19,21)