(phenylmethyl) (4S)-2-azanyl-4-butyl-5-oxidanylidene-4H-imidazole-3-carboxylate

Systemtic Name: (phenylmethyl) (4S)-2-azanyl-4-butyl-5-oxidanylidene-4H-imidazole-3-carboxylate Openeye Name: benzyl (4S)-2-amino-4-butyl-5-oxo-4H-imidazole-3-carboxylate CAS Name: (4S)-2-amino-4-butyl-5-oxo-4H-imidazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-2-amino-4-butyl-5-oxo-4H-imidazole-3-carboxylate Traditional Name: (5S)-2-amino-5-butyl-4-keto-2-imidazoline-1-carboxylic acid benzyl ester Formula: C15H19N3O3 MolecularWeight: 289.32966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N=C(N1C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CCCC[C@H]1C(=O)N=C(N1C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C15H19N3O3/c1-2-3-9-12-13(19)17-14(16)18(12)15(20)21-10-11-7-5-4-6-8-11/h4-8,12H,2-3,9-10H2,1H3,(H2,16,17,19)/t12-/m0/s1