3-[3-[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]propanoylamino]propanoic acid

Systemtic Name: 3-[3-[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]propanoylamino]propanoic acid Openeye Name: 3-[3-[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]propanoylamino]propanoic acid CAS Name: 3-[[3-[[(5-carbamimidoyl-1H-indol-2-yl)-oxomethyl]amino]-1-oxopropyl]amino]propanoic acid IUPAC Name: 3-[3-[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]propanoylamino]propanoic acid Traditional Name: 3-[3-[(5-amidino-1H-indole-2-carbonyl)amino]propanoylamino]propionic acid Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=N)N)C=C(N2)C(=O)NCCC(=O)NCCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(=N)N)C=C(N2)C(=O)NCCC(=O)NCCC(=O)O

InChI

InChI=1S/C16H19N5O4/c17-15(18)9-1-2-11-10(7-9)8-12(21-11)16(25)20-5-3-13(22)19-6-4-14(23)24/h1-2,7-8,21H,3-6H2,(H3,17,18)(H,19,22)(H,20,25)(H,23,24)