4-[2,5-dimethyl-3-[(Z)-(2-oxidanylidene-1-phenyl-indol-3-ylidene)methyl]pyrrol-1-yl]benzoic acid

Systemtic Name: 4-[2,5-dimethyl-3-[(Z)-(2-oxidanylidene-1-phenyl-indol-3-ylidene)methyl]pyrrol-1-yl]benzoic acid Openeye Name: 4-[2,5-dimethyl-3-[(Z)-(2-oxo-1-phenyl-indolin-3-ylidene)methyl]pyrrol-1-yl]benzoic acid CAS Name: 4-[2,5-dimethyl-3-[(Z)-(2-oxo-1-phenyl-3-indolylidene)methyl]-1-pyrrolyl]benzoic acid IUPAC Name: 4-[2,5-dimethyl-3-[(Z)-(2-oxo-1-phenylindol-3-ylidene)methyl]pyrrol-1-yl]benzoic acid Traditional Name: 4-[3-[(Z)-(2-keto-1-phenyl-indolin-3-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid Formula: C28H22N2O3 MolecularWeight: 434.48588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)O)C)C=C3C4=CC=CC=C4N(C3=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)O)C)/C=C\3/C4=CC=CC=C4N(C3=O)C5=CC=CC=C5

InChI

InChI=1S/C28H22N2O3/c1-18-16-21(19(2)29(18)23-14-12-20(13-15-23)28(32)33)17-25-24-10-6-7-11-26(24)30(27(25)31)22-8-4-3-5-9-22/h3-17H,1-2H3,(H,32,33)/b25-17-