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2-[5-benzamido-2-(4-carbamimidoylphenoxy)phenyl]benzoic acid

2-[5-benzamido-2-(4-carbamimidoylphenoxy)phenyl]benzoic acid

Systemtic Name:2-[5-benzamido-2-(4-carbamimidoylphenoxy)phenyl]benzoic acid
Openeye Name:2-[5-benzamido-2-(4-carbamimidoylphenoxy)phenyl]benzoic acid
CAS Name:2-[5-benzamido-2-(4-carbamimidoylphenoxy)phenyl]benzoic acid
IUPAC Name:2-[5-benzamido-2-(4-carbamimidoylphenoxy)phenyl]benzoic acid
Traditional Name:2-[2-(4-amidinophenoxy)-5-benzamido-phenyl]benzoic acid
Formula: C27H21N3O4
MolecularWeight: 451.47334
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC3=CC=C(C=C3)C(=N)N)C4=CC=CC=C4C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC3=CC=C(C=C3)C(=N)N)C4=CC=CC=C4C(=O)O


InChI

InChI=1S/C27H21N3O4/c28-25(29)17-10-13-20(14-11-17)34-24-15-12-19(30-26(31)18-6-2-1-3-7-18)16-23(24)21-8-4-5-9-22(21)27(32)33/h1-16H,(H3,28,29)(H,30,31)(H,32,33)


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