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

Systemtic Name: 2-chloranyl-5-[[2,5-dimethyl-1-(4-phenylphenyl)pyrrol-3-yl]methylideneamino]benzoic acid Openeye Name: 2-chloro-5-[[2,5-dimethyl-1-(4-phenylphenyl)pyrrol-3-yl]methyleneamino]benzoic acid CAS Name: 2-chloro-5-[[2,5-dimethyl-1-(4-phenylphenyl)-3-pyrrolyl]methylideneamino]benzoic acid IUPAC Name: 2-chloro-5-[[2,5-dimethyl-1-(4-phenylphenyl)pyrrol-3-yl]methylideneamino]benzoic acid Traditional Name: 2-chloro-5-[[2,5-dimethyl-1-(4-phenylphenyl)pyrrol-3-yl]methyleneamino]benzoic acid Formula: C26H21ClN2O2 MolecularWeight: 428.91014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C3=CC=CC=C3)C)C=NC4=CC(=C(C=C4)Cl)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C3=CC=CC=C3)C)C=NC4=CC(=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C26H21ClN2O2/c1-17-14-21(16-28-22-10-13-25(27)24(15-22)26(30)31)18(2)29(17)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-16H,1-2H3,(H,30,31)