methyl 5-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]carbamoyl]piperidin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]carbamoyl]piperidin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]carbamoyl]-1-piperidyl]-5-oxo-pentanoate CAS Name: 5-[4-[[4-(1,3-benzoxazol-2-yl)anilino]-oxomethyl]-1-piperidinyl]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]carbamoyl]piperidin-1-yl]-5-oxopentanoate Traditional Name: 5-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]carbamoyl]piperidino]-5-keto-valeric acid methyl ester Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

COC(=O)CCCC(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C25H27N3O5/c1-32-23(30)8-4-7-22(29)28-15-13-17(14-16-28)24(31)26-19-11-9-18(10-12-19)25-27-20-5-2-3-6-21(20)33-25/h2-3,5-6,9-12,17H,4,7-8,13-16H2,1H3,(H,26,31)