2-[5-carbamimidoyl-2-(6-carbamimidoyl-1H-indol-2-yl)phenoxy]propanoic acid

Systemtic Name: 2-[5-carbamimidoyl-2-(6-carbamimidoyl-1H-indol-2-yl)phenoxy]propanoic acid Openeye Name: 2-[5-carbamimidoyl-2-(6-carbamimidoyl-1H-indol-2-yl)phenoxy]propanoic acid CAS Name: 2-[5-carbamimidoyl-2-(6-carbamimidoyl-1H-indol-2-yl)phenoxy]propanoic acid IUPAC Name: 2-[5-carbamimidoyl-2-(6-carbamimidoyl-1H-indol-2-yl)phenoxy]propanoic acid Traditional Name: 2-[5-amidino-2-(6-amidino-1H-indol-2-yl)phenoxy]propionic acid Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=CC(=C1)C(=N)N)C2=CC3=C(N2)C=C(C=C3)C(=N)N

Isomeric SMILES

CC(C(=O)O)OC1=C(C=CC(=C1)C(=N)N)C2=CC3=C(N2)C=C(C=C3)C(=N)N

InChI

InChI=1S/C19H19N5O3/c1-9(19(25)26)27-16-8-12(18(22)23)4-5-13(16)15-6-10-2-3-11(17(20)21)7-14(10)24-15/h2-9,24H,1H3,(H3,20,21)(H3,22,23)(H,25,26)