5-[4-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(7-chloro-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-cyclopropyl-oxazole-4-carbonitrile CAS Name: 5-[4-[(7-chloro-1,3-benzodioxol-5-yl)-oxomethyl]-1-piperazinyl]-2-cyclopropyl-4-oxazolecarbonitrile IUPAC Name: 5-[4-(7-chloro-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(7-chloropiperonyloyl)piperazino]-2-cyclopropyl-oxazole-4-carbonitrile Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CC5=C(C(=C4)Cl)OCO5)C#N

Isomeric SMILES

C1CC1C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CC5=C(C(=C4)Cl)OCO5)C#N

InChI

InChI=1S/C19H17ClN4O4/c20-13-7-12(8-15-16(13)27-10-26-15)18(25)23-3-5-24(6-4-23)19-14(9-21)22-17(28-19)11-1-2-11/h7-8,11H,1-6,10H2