(4S,5R)-2-butyl-5-(carboxymethyl)-1-phenyl-4,5-dihydroimidazole-4-carboxylic acid

Systemtic Name: (4S,5R)-2-butyl-5-(carboxymethyl)-1-phenyl-4,5-dihydroimidazole-4-carboxylic acid Openeye Name: (4S,5R)-2-butyl-5-(carboxymethyl)-1-phenyl-4,5-dihydroimidazole-4-carboxylic acid CAS Name: (4S,5R)-2-butyl-5-(carboxymethyl)-1-phenyl-4,5-dihydroimidazole-4-carboxylic acid IUPAC Name: (4S,5R)-2-butyl-5-(carboxymethyl)-1-phenyl-4,5-dihydroimidazole-4-carboxylic acid Traditional Name: (4S,5R)-2-butyl-5-(carboxymethyl)-1-phenyl-2-imidazoline-4-carboxylic acid Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(C(N1C2=CC=CC=C2)CC(=O)O)C(=O)O

Isomeric SMILES

CCCCC1=N[C@@H]([C@H](N1C2=CC=CC=C2)CC(=O)O)C(=O)O

InChI

InChI=1S/C16H20N2O4/c1-2-3-9-13-17-15(16(21)22)12(10-14(19)20)18(13)11-7-5-4-6-8-11/h4-8,12,15H,2-3,9-10H2,1H3,(H,19,20)(H,21,22)/t12-,15+/m1/s1