3-[[5-[5-[bis(azanyl)methylideneamino]pentanoylamino]-2-oxidanyl-phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[5-[5-[bis(azanyl)methylideneamino]pentanoylamino]-2-oxidanyl-phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[5-(5-guanidinopentanoylamino)-2-hydroxy-benzoyl]amino]propanoic acid CAS Name: 3-[[[5-[[5-(diaminomethylideneamino)-1-oxopentyl]amino]-2-hydroxyphenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[5-[5-(diaminomethylideneamino)pentanoylamino]-2-hydroxybenzoyl]amino]propanoic acid Traditional Name: 3-[[5-(5-guanidinopentanoylamino)-2-hydroxy-benzoyl]amino]propionic acid Formula: C16H23N5O5 MolecularWeight: 365.38432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCCCN=C(N)N)C(=O)NCCC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCCCN=C(N)N)C(=O)NCCC(=O)O)O

InChI

InChI=1S/C16H23N5O5/c17-16(18)20-7-2-1-3-13(23)21-10-4-5-12(22)11(9-10)15(26)19-8-6-14(24)25/h4-5,9,22H,1-3,6-8H2,(H,19,26)(H,21,23)(H,24,25)(H4,17,18,20)