3-[[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]methyl]benzoic acid

Systemtic Name: 3-[[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]methyl]benzoic acid Openeye Name: 3-[[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]methyl]benzoic acid CAS Name: 3-[[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]methyl]benzoic acid IUPAC Name: 3-[[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]methyl]benzoic acid Traditional Name: 3-[[6-amidino-2-(4-amidinophenyl)-1H-indol-3-yl]methyl]benzoic acid Formula: C24H21N5O2 MolecularWeight: 411.45584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CC2=C(NC3=C2C=CC(=C3)C(=N)N)C4=CC=C(C=C4)C(=N)N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CC2=C(NC3=C2C=CC(=C3)C(=N)N)C4=CC=C(C=C4)C(=N)N)C(=O)O

InChI

InChI=1S/C24H21N5O2/c25-22(26)15-6-4-14(5-7-15)21-19(11-13-2-1-3-17(10-13)24(30)31)18-9-8-16(23(27)28)12-20(18)29-21/h1-10,12,29H,11H2,(H3,25,26)(H3,27,28)(H,30,31)