(2S,4R)-2-azanyl-4-[4-oxidanylidene-4-[(2-oxidanylidene-2-phenylazanyl-ethyl)amino]butyl]pentanedioic acid

Systemtic Name: (2S,4R)-2-azanyl-4-[4-oxidanylidene-4-[(2-oxidanylidene-2-phenylazanyl-ethyl)amino]butyl]pentanedioic acid Openeye Name: (2S,4R)-2-amino-4-[4-[(2-anilino-2-oxo-ethyl)amino]-4-oxo-butyl]pentanedioic acid CAS Name: (2S,4R)-2-amino-4-[4-[(2-anilino-2-oxoethyl)amino]-4-oxobutyl]pentanedioic acid IUPAC Name: (2S,4R)-2-amino-4-[4-[(2-anilino-2-oxoethyl)amino]-4-oxobutyl]pentanedioic acid Traditional Name: (2S,4R)-2-amino-4-[4-[(2-anilino-2-keto-ethyl)amino]-4-keto-butyl]glutaric acid Formula: C17H23N3O6 MolecularWeight: 365.38102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CNC(=O)CCCC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O6/c18-13(17(25)26)9-11(16(23)24)5-4-8-14(21)19-10-15(22)20-12-6-2-1-3-7-12/h1-3,6-7,11,13H,4-5,8-10,18H2,(H,19,21)(H,20,22)(H,23,24)(H,25,26)/t11-,13+/m1/s1