3-[[1-methyl-2-(3-piperidin-4-ylpropyl)benzimidazol-4-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[1-methyl-2-(3-piperidin-4-ylpropyl)benzimidazol-4-yl]carbonylamino]propanoic acid Openeye Name: 3-[[1-methyl-2-[3-(4-piperidyl)propyl]benzimidazole-4-carbonyl]amino]propanoic acid CAS Name: 3-[[[1-methyl-2-[3-(4-piperidinyl)propyl]-4-benzimidazolyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[1-methyl-2-(3-piperidin-4-ylpropyl)benzimidazole-4-carbonyl]amino]propanoic acid Traditional Name: 3-[[1-methyl-2-[3-(4-piperidyl)propyl]benzimidazole-4-carbonyl]amino]propionic acid Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC(=C2N=C1CCCC3CCNCC3)C(=O)NCCC(=O)O

Isomeric SMILES

CN1C2=CC=CC(=C2N=C1CCCC3CCNCC3)C(=O)NCCC(=O)O

InChI

InChI=1S/C20H28N4O3/c1-24-16-6-3-5-15(20(27)22-13-10-18(25)26)19(16)23-17(24)7-2-4-14-8-11-21-12-9-14/h3,5-6,14,21H,2,4,7-13H2,1H3,(H,22,27)(H,25,26)