2-[[4-(3,4-dimethylphenoxy)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: 2-[[4-(3,4-dimethylphenoxy)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: 2-[[4-(3,4-dimethylphenoxy)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 2-[[4-(3,4-dimethylphenoxy)anilino]-oxomethyl]-5-nitrobenzoate IUPAC Name: 2-[[4-(3,4-dimethylphenoxy)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 2-[[4-(3,4-dimethylphenoxy)phenyl]carbamoyl]-5-nitro-benzoate Formula: C22H17N2O6- MolecularWeight: 405.38018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)[O-])C

InChI

InChI=1S/C22H18N2O6/c1-13-3-7-18(11-14(13)2)30-17-8-4-15(5-9-17)23-21(25)19-10-6-16(24(28)29)12-20(19)22(26)27/h3-12H,1-2H3,(H,23,25)(H,26,27)/p-1