2-[4-[[3-[bis(azanyl)methylideneamino]phenyl]carbonylamino]phenoxy]propanoic acid

Systemtic Name: 2-[4-[[3-[bis(azanyl)methylideneamino]phenyl]carbonylamino]phenoxy]propanoic acid Openeye Name: 2-[4-[(3-guanidinobenzoyl)amino]phenoxy]propanoic acid CAS Name: 2-[4-[[[3-(diaminomethylideneamino)phenyl]-oxomethyl]amino]phenoxy]propanoic acid IUPAC Name: 2-[4-[[3-(diaminomethylideneamino)benzoyl]amino]phenoxy]propanoic acid Traditional Name: 2-[4-[(3-guanidinobenzoyl)amino]phenoxy]propionic acid Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)N=C(N)N

Isomeric SMILES

CC(C(=O)O)OC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)N=C(N)N

InChI

InChI=1S/C17H18N4O4/c1-10(16(23)24)25-14-7-5-12(6-8-14)20-15(22)11-3-2-4-13(9-11)21-17(18)19/h2-10H,1H3,(H,20,22)(H,23,24)(H4,18,19,21)