4-[[6-(5-phenyl-1H-pyrrol-2-yl)naphthalen-2-yl]oxymethyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4-[[6-(5-phenyl-1H-pyrrol-2-yl)naphthalen-2-yl]oxymethyl]benzene-1,3-dicarboxylic acid Openeye Name: 4-[[6-(5-phenyl-1H-pyrrol-2-yl)-2-naphthyl]oxymethyl]benzene-1,3-dicarboxylic acid CAS Name: 4-[[6-(5-phenyl-1H-pyrrol-2-yl)-2-naphthalenyl]oxymethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-[[6-(5-phenyl-1H-pyrrol-2-yl)naphthalen-2-yl]oxymethyl]benzene-1,3-dicarboxylic acid Traditional Name: 4-[[6-(5-phenyl-1H-pyrrol-2-yl)-2-naphthoxy]methyl]isophthalic acid Formula: C29H21NO5 MolecularWeight: 463.48074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(N2)C3=CC4=C(C=C3)C=C(C=C4)OCC5=C(C=C(C=C5)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(N2)C3=CC4=C(C=C3)C=C(C=C4)OCC5=C(C=C(C=C5)C(=O)O)C(=O)O

InChI

InChI=1S/C29H21NO5/c31-28(32)22-8-9-23(25(16-22)29(33)34)17-35-24-11-10-19-14-21(7-6-20(19)15-24)27-13-12-26(30-27)18-4-2-1-3-5-18/h1-16,30H,17H2,(H,31,32)(H,33,34)