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4-[bis(1H-pyrrol-2-yl)methyl]benzoic acid

4-[bis(1H-pyrrol-2-yl)methyl]benzoic acid

Systemtic Name:4-[bis(1H-pyrrol-2-yl)methyl]benzoic acid
Openeye Name:4-[bis(1H-pyrrol-2-yl)methyl]benzoic acid
CAS Name:4-[bis(1H-pyrrol-2-yl)methyl]benzoic acid
IUPAC Name:4-[bis(1H-pyrrol-2-yl)methyl]benzoic acid
Traditional Name:4-[bis(1H-pyrrol-2-yl)methyl]benzoic acid
Formula: C16H14N2O2
MolecularWeight: 266.29456
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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1)C(C2=CC=C(C=C2)C(=O)O)C3=CC=CN3


Isomeric SMILES

C1=CNC(=C1)C(C2=CC=C(C=C2)C(=O)O)C3=CC=CN3


InChI

InChI=1S/C16H14N2O2/c19-16(20)12-7-5-11(6-8-12)15(13-3-1-9-17-13)14-4-2-10-18-14/h1-10,15,17-18H,(H,19,20)


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