(2S)-2-azanyl-5-oxidanylidene-5-[[4-(3-phenylpropoxy)phenyl]amino]pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-oxidanylidene-5-[[4-(3-phenylpropoxy)phenyl]amino]pentanoic acid Openeye Name: (2S)-2-amino-5-oxo-5-[4-(3-phenylpropoxy)anilino]pentanoic acid CAS Name: (2S)-2-amino-5-oxo-5-[4-(3-phenylpropoxy)anilino]pentanoic acid IUPAC Name: (2S)-2-amino-5-oxo-5-[4-(3-phenylpropoxy)anilino]pentanoic acid Traditional Name: (2S)-2-amino-5-keto-5-[4-(3-phenylpropoxy)anilino]valeric acid Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)NC(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C20H24N2O4/c21-18(20(24)25)12-13-19(23)22-16-8-10-17(11-9-16)26-14-4-7-15-5-2-1-3-6-15/h1-3,5-6,8-11,18H,4,7,12-14,21H2,(H,22,23)(H,24,25)/t18-/m0/s1