methyl 3-[2-azanyl-1-[(4-chlorophenyl)methyl]benzimidazol-5-yl]propanoate

Systemtic Name: methyl 3-[2-azanyl-1-[(4-chlorophenyl)methyl]benzimidazol-5-yl]propanoate Openeye Name: methyl 3-[2-amino-1-[(4-chlorophenyl)methyl]benzimidazol-5-yl]propanoate CAS Name: 3-[2-amino-1-[(4-chlorophenyl)methyl]-5-benzimidazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-amino-1-[(4-chlorophenyl)methyl]benzimidazol-5-yl]propanoate Traditional Name: 3-[2-amino-1-(4-chlorobenzyl)benzimidazol-5-yl]propionic acid methyl ester Formula: C18H18ClN3O2 MolecularWeight: 343.80742

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC2=C(C=C1)N(C(=N2)N)CC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)CCC1=CC2=C(C=C1)N(C(=N2)N)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O2/c1-24-17(23)9-5-12-4-8-16-15(10-12)21-18(20)22(16)11-13-2-6-14(19)7-3-13/h2-4,6-8,10H,5,9,11H2,1H3,(H2,20,21)