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3-[2-[[bis(azanyl)methylideneamino]methyl-(phenylcarbonyl)amino]phenyl]propanoate

3-[2-[[bis(azanyl)methylideneamino]methyl-(phenylcarbonyl)amino]phenyl]propanoate

Systemtic Name:3-[2-[[bis(azanyl)methylideneamino]methyl-(phenylcarbonyl)amino]phenyl]propanoate
Openeye Name:3-[2-[benzoyl(guanidinomethyl)amino]phenyl]propanoate
CAS Name:3-[2-[benzoyl-[(diaminomethylideneamino)methyl]amino]phenyl]propanoate
IUPAC Name:3-[2-[benzoyl-[(diaminomethylideneamino)methyl]amino]phenyl]propanoate
Traditional Name:3-[2-[benzoyl(guanidinomethyl)amino]phenyl]propionate
Formula: C18H19N4O3-
MolecularWeight: 339.36846
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N(CN=C(N)N)C2=CC=CC=C2CCC(=O)[O-]


Isomeric SMILES

C1=CC=C(C=C1)C(=O)N(CN=C(N)N)C2=CC=CC=C2CCC(=O)[O-]


InChI

InChI=1S/C18H20N4O3/c19-18(20)21-12-22(17(25)14-7-2-1-3-8-14)15-9-5-4-6-13(15)10-11-16(23)24/h1-9H,10-12H2,(H,23,24)(H4,19,20,21)/p-1


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