(diphenylmethyl) 4-[3-(2-oxidanyl-2,3-dihydro-1,3-benzoxazol-6-yl)-3-oxidanylidene-propyl]piperazine-1-carboxylate

Systemtic Name: (diphenylmethyl) 4-[3-(2-oxidanyl-2,3-dihydro-1,3-benzoxazol-6-yl)-3-oxidanylidene-propyl]piperazine-1-carboxylate Openeye Name: benzhydryl 4-[3-(2-hydroxy-2,3-dihydro-1,3-benzoxazol-6-yl)-3-oxo-propyl]piperazine-1-carboxylate CAS Name: 4-[3-(2-hydroxy-2,3-dihydro-1,3-benzoxazol-6-yl)-3-oxopropyl]-1-piperazinecarboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 4-[3-(2-hydroxy-2,3-dihydro-1,3-benzoxazol-6-yl)-3-oxopropyl]piperazine-1-carboxylate Traditional Name: 4-[3-(2-hydroxy-2,3-dihydro-1,3-benzoxazol-6-yl)-3-keto-propyl]piperazine-1-carboxylic acid benzhydryl ester Formula: C28H29N3O5 MolecularWeight: 487.54696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)C2=CC3=C(C=C2)NC(O3)O)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCC(=O)C2=CC3=C(C=C2)NC(O3)O)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O5/c32-24(22-11-12-23-25(19-22)35-27(33)29-23)13-14-30-15-17-31(18-16-30)28(34)36-26(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,19,26-27,29,33H,13-18H2