4-[[4,5-dihydro-1H-imidazol-2-yl(2-hydroxyethyl)amino]methyl-(phenylcarbonyl)amino]butanoic acid

Systemtic Name: 4-[[4,5-dihydro-1H-imidazol-2-yl(2-hydroxyethyl)amino]methyl-(phenylcarbonyl)amino]butanoic acid Openeye Name: 4-[benzoyl-[[4,5-dihydro-1H-imidazol-2-yl(2-hydroxyethyl)amino]methyl]amino]butanoic acid CAS Name: 4-[benzoyl-[[4,5-dihydro-1H-imidazol-2-yl(2-hydroxyethyl)amino]methyl]amino]butanoic acid IUPAC Name: 4-[benzoyl-[[4,5-dihydro-1H-imidazol-2-yl(2-hydroxyethyl)amino]methyl]amino]butanoic acid Traditional Name: 4-[benzoyl-[[2-hydroxyethyl(2-imidazolin-2-yl)amino]methyl]amino]butyric acid Formula: C17H24N4O4 MolecularWeight: 348.39686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)N(CCO)CN(CCCC(=O)O)C(=O)C2=CC=CC=C2

Isomeric SMILES

C1CN=C(N1)N(CCO)CN(CCCC(=O)O)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H24N4O4/c22-12-11-21(17-18-8-9-19-17)13-20(10-4-7-15(23)24)16(25)14-5-2-1-3-6-14/h1-3,5-6,22H,4,7-13H2,(H,18,19)(H,23,24)