(phenylmethyl) 4-[2-[(5-chloranyl-1,3-benzoxazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-[(5-chloranyl-1,3-benzoxazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylate Openeye Name: benzyl 4-[2-[(5-chloro-1,3-benzoxazol-2-yl)amino]-2-oxo-ethyl]-4-phenyl-piperidine-1-carboxylate CAS Name: 4-[2-[(5-chloro-1,3-benzoxazol-2-yl)amino]-2-oxoethyl]-4-phenyl-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-[(5-chloro-1,3-benzoxazol-2-yl)amino]-2-oxoethyl]-4-phenylpiperidine-1-carboxylate Traditional Name: 4-[2-[(5-chloro-1,3-benzoxazol-2-yl)amino]-2-keto-ethyl]-4-phenyl-piperidine-1-carboxylic acid benzyl ester Formula: C28H26ClN3O4 MolecularWeight: 503.97674

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC(=O)NC2=NC3=C(O2)C=CC(=C3)Cl)C4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1(CC(=O)NC2=NC3=C(O2)C=CC(=C3)Cl)C4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C28H26ClN3O4/c29-22-11-12-24-23(17-22)30-26(36-24)31-25(33)18-28(21-9-5-2-6-10-21)13-15-32(16-14-28)27(34)35-19-20-7-3-1-4-8-20/h1-12,17H,13-16,18-19H2,(H,30,31,33)