methyl 3-[[2-[4-(4-cyanophenyl)phenoxy]ethanoylamino]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[2-[4-(4-cyanophenyl)phenoxy]ethanoylamino]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[2-[4-(4-cyanophenyl)phenoxy]-1-oxoethyl]hydrazo]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C24H18N4O7 MolecularWeight: 474.42232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NNC(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NNC(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C24H18N4O7/c1-34-24(31)19-10-18(11-20(12-19)28(32)33)23(30)27-26-22(29)14-35-21-8-6-17(7-9-21)16-4-2-15(13-25)3-5-16/h2-12H,14H2,1H3,(H,26,29)(H,27,30)