3-[3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]-4-piperidin-1-yl-benzamide

Systemtic Name: 3-[3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]-4-piperidin-1-yl-benzamide Openeye Name: 3-[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoylamino]-4-(1-piperidyl)benzamide CAS Name: 3-[[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-1-oxopropyl]amino]-4-(1-piperidinyl)benzamide IUPAC Name: 3-[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoylamino]-4-piperidin-1-ylbenzamide Traditional Name: 3-[3-(6-chloro-2-keto-1,3-benzoxazol-3-yl)propanoylamino]-4-piperidino-benzamide Formula: C22H23ClN4O4 MolecularWeight: 442.89542

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)N)NC(=O)CCN3C4=C(C=C(C=C4)Cl)OC3=O

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)N)NC(=O)CCN3C4=C(C=C(C=C4)Cl)OC3=O

InChI

InChI=1S/C22H23ClN4O4/c23-15-5-7-18-19(13-15)31-22(30)27(18)11-8-20(28)25-16-12-14(21(24)29)4-6-17(16)26-9-2-1-3-10-26/h4-7,12-13H,1-3,8-11H2,(H2,24,29)(H,25,28)