(2S)-2-[2-[(1S)-1-azanylpropyl]-5,6-dimethyl-benzimidazol-1-yl]propanoic acid

Systemtic Name: (2S)-2-[2-[(1S)-1-azanylpropyl]-5,6-dimethyl-benzimidazol-1-yl]propanoic acid Openeye Name: (2S)-2-[2-[(1S)-1-aminopropyl]-5,6-dimethyl-benzimidazol-1-yl]propanoic acid CAS Name: (2S)-2-[2-[(1S)-1-aminopropyl]-5,6-dimethyl-1-benzimidazolyl]propanoic acid IUPAC Name: (2S)-2-[2-[(1S)-1-aminopropyl]-5,6-dimethylbenzimidazol-1-yl]propanoic acid Traditional Name: (2S)-2-[2-[(1S)-1-aminopropyl]-5,6-dimethyl-benzimidazol-1-yl]propionic acid Formula: C15H21N3O2 MolecularWeight: 275.34614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(N1C(C)C(=O)O)C=C(C(=C2)C)C)N

Isomeric SMILES

CC[C@@H](C1=NC2=C(N1[C@@H](C)C(=O)O)C=C(C(=C2)C)C)N

InChI

InChI=1S/C15H21N3O2/c1-5-11(16)14-17-12-6-8(2)9(3)7-13(12)18(14)10(4)15(19)20/h6-7,10-11H,5,16H2,1-4H3,(H,19,20)/t10-,11-/m0/s1