3-[3-(5-carbamimidoyl-1H-indol-2-yl)-5-(carboxymethyl)-2-oxidanyl-phenyl]benzoic acid

Systemtic Name: 3-[3-(5-carbamimidoyl-1H-indol-2-yl)-5-(carboxymethyl)-2-oxidanyl-phenyl]benzoic acid Openeye Name: 3-[3-(5-carbamimidoyl-1H-indol-2-yl)-5-(carboxymethyl)-2-hydroxy-phenyl]benzoic acid CAS Name: 3-[3-(5-carbamimidoyl-1H-indol-2-yl)-5-(carboxymethyl)-2-hydroxyphenyl]benzoic acid IUPAC Name: 3-[3-(5-carbamimidoyl-1H-indol-2-yl)-5-(carboxymethyl)-2-hydroxyphenyl]benzoic acid Traditional Name: 3-[3-(5-amidino-1H-indol-2-yl)-5-(carboxymethyl)-2-hydroxy-phenyl]benzoic acid Formula: C24H19N3O5 MolecularWeight: 429.42476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C2=CC(=CC(=C2O)C3=CC4=C(N3)C=CC(=C4)C(=N)N)CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C2=CC(=CC(=C2O)C3=CC4=C(N3)C=CC(=C4)C(=N)N)CC(=O)O

InChI

InChI=1S/C24H19N3O5/c25-23(26)14-4-5-19-16(10-14)11-20(27-19)18-7-12(8-21(28)29)6-17(22(18)30)13-2-1-3-15(9-13)24(31)32/h1-7,9-11,27,30H,8H2,(H3,25,26)(H,28,29)(H,31,32)