4-[[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzoic acid

Systemtic Name: 4-[[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzoic acid Openeye Name: 4-[[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzoic acid CAS Name: 4-[[1-(4-chlorophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]benzoic acid IUPAC Name: 4-[[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]benzoic acid Traditional Name: 4-[[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzoic acid Formula: C20H17ClN2O2 MolecularWeight: 352.81418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C=NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C=NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H17ClN2O2/c1-13-11-16(12-22-18-7-3-15(4-8-18)20(24)25)14(2)23(13)19-9-5-17(21)6-10-19/h3-12H,1-2H3,(H,24,25)