tert-butyl 4-[(3-phenyl-2,1-benzoxazol-5-yl)carbonyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-phenyl-2,1-benzoxazol-5-yl)carbonyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-phenyl-2,1-benzoxazole-5-carbonyl)piperazine-1-carboxylate CAS Name: 4-[oxo-(3-phenyl-2,1-benzoxazol-5-yl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-phenyl-2,1-benzoxazole-5-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(3-phenylanthranil-5-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O4/c1-23(2,3)29-22(28)26-13-11-25(12-14-26)21(27)17-9-10-19-18(15-17)20(30-24-19)16-7-5-4-6-8-16/h4-10,15H,11-14H2,1-3H3