3-[2-(1-azanylethylideneamino)phenyl]propanoic acid hydrate dihydrochloride

Systemtic Name: 3-[2-(1-azanylethylideneamino)phenyl]propanoic acid hydrate dihydrochloride Openeye Name: 3-[2-(1-aminoethylideneamino)phenyl]propanoic acid hydrate dihydrochloride CAS Name: 3-[2-(1-aminoethylideneamino)phenyl]propanoic acid hydrate dihydrochloride IUPAC Name: 3-[2-(1-aminoethylideneamino)phenyl]propanoic acid hydrate dihydrochloride Traditional Name: 3-[2-(1-aminoethylideneamino)phenyl]propionic acid hydrate dihydrochloride Formula: C11H18Cl2N2O3 MolecularWeight: 297.17822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=CC=CC=C1CCC(=O)O)N.O.Cl.Cl

Isomeric SMILES

CC(=NC1=CC=CC=C1CCC(=O)O)N.O.Cl.Cl

InChI

InChI=1S/C11H14N2O2.2ClH.H2O/c1-8(12)13-10-5-3-2-4-9(10)6-7-11(14)15;;;/h2-5H,6-7H2,1H3,(H2,12,13)(H,14,15);2*1H;1H2