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

Systemtic Name: 4-[[2-[(4-methoxy-3-nitro-phenyl)carbonylamino]ethanoylamino]methyl]benzoate Openeye Name: 4-[[[2-[(4-methoxy-3-nitro-benzoyl)amino]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-1-oxoethyl]amino]methyl]benzoate IUPAC Name: 4-[[[2-[(4-methoxy-3-nitrobenzoyl)amino]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[(4-methoxy-3-nitro-benzoyl)amino]acetyl]amino]methyl]benzoate Formula: C18H16N3O7- MolecularWeight: 386.33554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)NCC2=CC=C(C=C2)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)NCC2=CC=C(C=C2)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O7/c1-28-15-7-6-13(8-14(15)21(26)27)17(23)20-10-16(22)19-9-11-2-4-12(5-3-11)18(24)25/h2-8H,9-10H2,1H3,(H,19,22)(H,20,23)(H,24,25)/p-1