(3S)-3-azanyl-6-oxidanylidene-6-[(4-phenoxyphenyl)amino]hexanoic acid

Systemtic Name: (3S)-3-azanyl-6-oxidanylidene-6-[(4-phenoxyphenyl)amino]hexanoic acid Openeye Name: (3S)-3-amino-6-oxo-6-(4-phenoxyanilino)hexanoic acid CAS Name: (3S)-3-amino-6-oxo-6-(4-phenoxyanilino)hexanoic acid IUPAC Name: (3S)-3-amino-6-oxo-6-(4-phenoxyanilino)hexanoic acid Traditional Name: (3S)-3-amino-6-keto-6-(4-phenoxyanilino)hexanoic acid Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCC(CC(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CC[C@@H](CC(=O)O)N

InChI

InChI=1S/C18H20N2O4/c19-13(12-18(22)23)6-11-17(21)20-14-7-9-16(10-8-14)24-15-4-2-1-3-5-15/h1-5,7-10,13H,6,11-12,19H2,(H,20,21)(H,22,23)/t13-/m0/s1