(2S,4R)-2-azanyl-4-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]pentanedioic acid

Systemtic Name: (2S,4R)-2-azanyl-4-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]pentanedioic acid Openeye Name: (2S,4R)-2-amino-4-[3-(benzylamino)-3-oxo-propyl]pentanedioic acid CAS Name: (2S,4R)-2-amino-4-[3-oxo-3-[(phenylmethyl)amino]propyl]pentanedioic acid IUPAC Name: (2S,4R)-2-amino-4-[3-(benzylamino)-3-oxopropyl]pentanedioic acid Traditional Name: (2S,4R)-2-amino-4-[3-(benzylamino)-3-keto-propyl]glutaric acid Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O5/c16-12(15(21)22)8-11(14(19)20)6-7-13(18)17-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9,16H2,(H,17,18)(H,19,20)(H,21,22)/t11-,12+/m1/s1