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

Systemtic Name: methyl 4-[[(3-methyl-2-nitro-phenyl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(3-methyl-2-nitro-benzoyl)amino]methyl]benzoate CAS Name: 4-[[[(3-methyl-2-nitrophenyl)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3-methyl-2-nitrobenzoyl)amino]methyl]benzoate Traditional Name: 4-[[(3-methyl-2-nitro-benzoyl)amino]methyl]benzoic acid methyl ester Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H16N2O5/c1-11-4-3-5-14(15(11)19(22)23)16(20)18-10-12-6-8-13(9-7-12)17(21)24-2/h3-9H,10H2,1-2H3,(H,18,20)