(2S,3R)-2-azanyl-3-butyl-2-phenethyl-pentanedioic acid

Systemtic Name: (2S,3R)-2-azanyl-3-butyl-2-phenethyl-pentanedioic acid Openeye Name: (2S,3R)-2-amino-3-butyl-2-phenethyl-pentanedioic acid CAS Name: (2S,3R)-2-amino-3-butyl-2-phenethylpentanedioic acid IUPAC Name: (2S,3R)-2-amino-3-butyl-2-phenethylpentanedioic acid Traditional Name: (2S,3R)-2-amino-3-butyl-2-phenethyl-glutaric acid Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)O)C(CCC1=CC=CC=C1)(C(=O)O)N

Isomeric SMILES

CCCC[C@H](CC(=O)O)[C@@](CCC1=CC=CC=C1)(C(=O)O)N

InChI

InChI=1S/C17H25NO4/c1-2-3-9-14(12-15(19)20)17(18,16(21)22)11-10-13-7-5-4-6-8-13/h4-8,14H,2-3,9-12,18H2,1H3,(H,19,20)(H,21,22)/t14-,17+/m1/s1