5-(4-chloranylphenoxy)-1-(4-methyl-3-nitro-phenyl)indole-2-carboxylic acid

Systemtic Name: 5-(4-chloranylphenoxy)-1-(4-methyl-3-nitro-phenyl)indole-2-carboxylic acid Openeye Name: 5-(4-chlorophenoxy)-1-(4-methyl-3-nitro-phenyl)indole-2-carboxylic acid CAS Name: 5-(4-chlorophenoxy)-1-(4-methyl-3-nitrophenyl)-2-indolecarboxylic acid IUPAC Name: 5-(4-chlorophenoxy)-1-(4-methyl-3-nitrophenyl)indole-2-carboxylic acid Traditional Name: 5-(4-chlorophenoxy)-1-(4-methyl-3-nitro-phenyl)indole-2-carboxylic acid Formula: C22H15ClN2O5 MolecularWeight: 422.8179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)C=C2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)C=C2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C22H15ClN2O5/c1-13-2-5-16(12-20(13)25(28)29)24-19-9-8-18(10-14(19)11-21(24)22(26)27)30-17-6-3-15(23)4-7-17/h2-12H,1H3,(H,26,27)