2-oxidanyl-2-[3-[(2-phenyl-1,3-benzoxazol-5-yl)oxy]propyl]piperazine-1-carboxylic acid

Systemtic Name: 2-oxidanyl-2-[3-[(2-phenyl-1,3-benzoxazol-5-yl)oxy]propyl]piperazine-1-carboxylic acid Openeye Name: 2-hydroxy-2-[3-[(2-phenyl-1,3-benzoxazol-5-yl)oxy]propyl]piperazine-1-carboxylic acid CAS Name: 2-hydroxy-2-[3-[(2-phenyl-1,3-benzoxazol-5-yl)oxy]propyl]-1-piperazinecarboxylic acid IUPAC Name: 2-hydroxy-2-[3-[(2-phenyl-1,3-benzoxazol-5-yl)oxy]propyl]piperazine-1-carboxylic acid Traditional Name: 2-hydroxy-2-[3-[(2-phenyl-1,3-benzoxazol-5-yl)oxy]propyl]piperazine-1-carboxylic acid Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)(CCCOC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4)O)C(=O)O

Isomeric SMILES

C1CN(C(CN1)(CCCOC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4)O)C(=O)O

InChI

InChI=1S/C21H23N3O5/c25-20(26)24-11-10-22-14-21(24,27)9-4-12-28-16-7-8-18-17(13-16)23-19(29-18)15-5-2-1-3-6-15/h1-3,5-8,13,22,27H,4,9-12,14H2,(H,25,26)