2-[[2-[(2-chlorophenyl)carbonylamino]ethanoylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[2-[(2-chlorophenyl)carbonylamino]ethanoylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[[2-[(2-chlorobenzoyl)amino]acetyl]amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[2-[[(2-chlorophenyl)-oxomethyl]amino]-1-oxoethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[[2-[(2-chlorobenzoyl)amino]acetyl]amino]methyl]-4-nitrophenolate Traditional Name: 2-[[[2-[(2-chlorobenzoyl)amino]acetyl]amino]methyl]-4-nitro-phenolate Formula: C16H13ClN3O5- MolecularWeight: 362.74452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3O5/c17-13-4-2-1-3-12(13)16(23)19-9-15(22)18-8-10-7-11(20(24)25)5-6-14(10)21/h1-7,21H,8-9H2,(H,18,22)(H,19,23)/p-1