methyl 3-azanyl-3-[4-[2-(4-carbamimidoylphenyl)ethyl]phenyl]propanoate dihydrochloride

Systemtic Name: methyl 3-azanyl-3-[4-[2-(4-carbamimidoylphenyl)ethyl]phenyl]propanoate dihydrochloride Openeye Name: methyl 3-amino-3-[4-[2-(4-carbamimidoylphenyl)ethyl]phenyl]propanoate dihydrochloride CAS Name: 3-amino-3-[4-[2-(4-carbamimidoylphenyl)ethyl]phenyl]propanoic acid methyl ester dihydrochloride IUPAC Name: methyl 3-amino-3-[4-[2-(4-carbamimidoylphenyl)ethyl]phenyl]propanoate dihydrochloride Traditional Name: 3-[4-[2-(4-amidinophenyl)ethyl]phenyl]-3-amino-propionic acid methyl ester dihydrochloride Formula: C19H25Cl2N3O2 MolecularWeight: 398.3267

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)CCC2=CC=C(C=C2)C(=N)N)N.Cl.Cl

Isomeric SMILES

COC(=O)CC(C1=CC=C(C=C1)CCC2=CC=C(C=C2)C(=N)N)N.Cl.Cl

InChI

InChI=1S/C19H23N3O2.2ClH/c1-24-18(23)12-17(20)15-8-4-13(5-9-15)2-3-14-6-10-16(11-7-14)19(21)22;;/h4-11,17H,2-3,12,20H2,1H3,(H3,21,22);2*1H