3-[2-[[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]carbamoyl]phenyl]-4-nitro-benzoic acid

Systemtic Name: 3-[2-[[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]carbamoyl]phenyl]-4-nitro-benzoic acid Openeye Name: 3-[2-[[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]carbamoyl]phenyl]-4-nitro-benzoic acid CAS Name: 3-[2-[[[2-(4-chloro-2-methylphenoxy)-1-oxoethyl]hydrazo]-oxomethyl]phenyl]-4-nitrobenzoic acid IUPAC Name: 3-[2-[[[2-(4-chloro-2-methylphenoxy)acetyl]amino]carbamoyl]phenyl]-4-nitrobenzoic acid Traditional Name: 3-[2-[[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]carbamoyl]phenyl]-4-nitro-benzoic acid Formula: C23H18ClN3O7 MolecularWeight: 483.85792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)NNC(=O)C2=CC=CC=C2C3=C(C=CC(=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)NNC(=O)C2=CC=CC=C2C3=C(C=CC(=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C23H18ClN3O7/c1-13-10-15(24)7-9-20(13)34-12-21(28)25-26-22(29)17-5-3-2-4-16(17)18-11-14(23(30)31)6-8-19(18)27(32)33/h2-11H,12H2,1H3,(H,25,28)(H,26,29)(H,30,31)