3-[[1-(2-ethyl-6-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzoic acid

Systemtic Name: 3-[[1-(2-ethyl-6-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzoic acid Openeye Name: 3-[[1-(2-ethyl-6-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzoic acid CAS Name: 3-[[1-(2-ethyl-6-methylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]benzoic acid IUPAC Name: 3-[[1-(2-ethyl-6-methylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]benzoic acid Traditional Name: 3-[[1-(2-ethyl-6-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzoic acid Formula: C23H24N2O2 MolecularWeight: 360.44886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1N2C(=CC(=C2C)C=NC3=CC=CC(=C3)C(=O)O)C)C

Isomeric SMILES

CCC1=CC=CC(=C1N2C(=CC(=C2C)C=NC3=CC=CC(=C3)C(=O)O)C)C

InChI

InChI=1S/C23H24N2O2/c1-5-18-9-6-8-15(2)22(18)25-16(3)12-20(17(25)4)14-24-21-11-7-10-19(13-21)23(26)27/h6-14H,5H2,1-4H3,(H,26,27)