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3-[(1-tetradecylbenzimidazol-2-yl)carbonylamino]propanoic acid

3-[(1-tetradecylbenzimidazol-2-yl)carbonylamino]propanoic acid

Systemtic Name:3-[(1-tetradecylbenzimidazol-2-yl)carbonylamino]propanoic acid
Openeye Name:3-[(1-tetradecylbenzimidazole-2-carbonyl)amino]propanoic acid
CAS Name:3-[[oxo-(1-tetradecyl-2-benzimidazolyl)methyl]amino]propanoic acid
IUPAC Name:3-[(1-tetradecylbenzimidazole-2-carbonyl)amino]propanoic acid
Traditional Name:3-[(1-myristylbenzimidazole-2-carbonyl)amino]propionic acid
Formula: C25H39N3O3
MolecularWeight: 429.59546
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1C(=O)NCCC(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1C(=O)NCCC(=O)O


InChI

InChI=1S/C25H39N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-15-20-28-22-17-14-13-16-21(22)27-24(28)25(31)26-19-18-23(29)30/h13-14,16-17H,2-12,15,18-20H2,1H3,(H,26,31)(H,29,30)


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