tert-butyl 4-[2-[[4-(5-bromanyl-7-methyl-1,3-benzoxazol-2-yl)phenyl]amino]-2-oxidanylidene-ethoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[[4-(5-bromanyl-7-methyl-1,3-benzoxazol-2-yl)phenyl]amino]-2-oxidanylidene-ethoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-(5-bromo-7-methyl-1,3-benzoxazol-2-yl)anilino]-2-oxo-ethoxy]piperidine-1-carboxylate CAS Name: 4-[2-[4-(5-bromo-7-methyl-1,3-benzoxazol-2-yl)anilino]-2-oxoethoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-(5-bromo-7-methyl-1,3-benzoxazol-2-yl)anilino]-2-oxoethoxy]piperidine-1-carboxylate Traditional Name: 4-[2-[4-(5-bromo-7-methyl-1,3-benzoxazol-2-yl)anilino]-2-keto-ethoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H30BrN3O5 MolecularWeight: 544.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1OC(=N2)C3=CC=C(C=C3)NC(=O)COC4CCN(CC4)C(=O)OC(C)(C)C)Br

Isomeric SMILES

CC1=CC(=CC2=C1OC(=N2)C3=CC=C(C=C3)NC(=O)COC4CCN(CC4)C(=O)OC(C)(C)C)Br

InChI

InChI=1S/C26H30BrN3O5/c1-16-13-18(27)14-21-23(16)34-24(29-21)17-5-7-19(8-6-17)28-22(31)15-33-20-9-11-30(12-10-20)25(32)35-26(2,3)4/h5-8,13-14,20H,9-12,15H2,1-4H3,(H,28,31)