methyl 3-[6-azanyl-1-(phenylmethyl)benzimidazol-2-yl]propanoate

Systemtic Name: methyl 3-[6-azanyl-1-(phenylmethyl)benzimidazol-2-yl]propanoate Openeye Name: methyl 3-(6-amino-1-benzyl-benzimidazol-2-yl)propanoate CAS Name: 3-[6-amino-1-(phenylmethyl)-2-benzimidazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-(6-amino-1-benzylbenzimidazol-2-yl)propanoate Traditional Name: 3-(6-amino-1-benzyl-benzimidazol-2-yl)propionic acid methyl ester Formula: C18H19N3O2 MolecularWeight: 309.36236

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=NC2=C(N1CC3=CC=CC=C3)C=C(C=C2)N

Isomeric SMILES

COC(=O)CCC1=NC2=C(N1CC3=CC=CC=C3)C=C(C=C2)N

InChI

InChI=1S/C18H19N3O2/c1-23-18(22)10-9-17-20-15-8-7-14(19)11-16(15)21(17)12-13-5-3-2-4-6-13/h2-8,11H,9-10,12,19H2,1H3