2-[3-[4-(4-carbamimidoylphenyl)phenyl]propyl]propanedioic acid

Systemtic Name: 2-[3-[4-(4-carbamimidoylphenyl)phenyl]propyl]propanedioic acid Openeye Name: 2-[3-[4-(4-carbamimidoylphenyl)phenyl]propyl]propanedioic acid CAS Name: 2-[3-[4-(4-carbamimidoylphenyl)phenyl]propyl]propanedioic acid IUPAC Name: 2-[3-[4-(4-carbamimidoylphenyl)phenyl]propyl]propanedioic acid Traditional Name: 2-[3-[4-(4-amidinophenyl)phenyl]propyl]malonic acid Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC(C(=O)O)C(=O)O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CCCC(C(=O)O)C(=O)O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H20N2O4/c20-17(21)15-10-8-14(9-11-15)13-6-4-12(5-7-13)2-1-3-16(18(22)23)19(24)25/h4-11,16H,1-3H2,(H3,20,21)(H,22,23)(H,24,25)