5-chloranyl-3-[4-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,3-benzoxazol-2-one

Systemtic Name: 5-chloranyl-3-[4-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,3-benzoxazol-2-one Openeye Name: 5-chloro-3-[4-oxo-4-[4-(2-pyridyl)piperazin-1-yl]butyl]-1,3-benzoxazol-2-one CAS Name: 5-chloro-3-[4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-1,3-benzoxazol-2-one IUPAC Name: 5-chloro-3-[4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,3-benzoxazol-2-one Traditional Name: 5-chloro-3-[4-keto-4-[4-(2-pyridyl)piperazino]butyl]-1,3-benzoxazol-2-one Formula: C20H21ClN4O3 MolecularWeight: 400.85874

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CCCN3C4=C(C=CC(=C4)Cl)OC3=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CCCN3C4=C(C=CC(=C4)Cl)OC3=O

InChI

InChI=1S/C20H21ClN4O3/c21-15-6-7-17-16(14-15)25(20(27)28-17)9-3-5-19(26)24-12-10-23(11-13-24)18-4-1-2-8-22-18/h1-2,4,6-8,14H,3,5,9-13H2