N-[2-(1-pent-4-enoylpiperidin-4-yl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-(1-pent-4-enoylpiperidin-4-yl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(1-pent-4-enoyl-4-piperidyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[1-(1-oxopent-4-enyl)-4-piperidinyl]-3-pyrazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(1-pent-4-enoylpiperidin-4-yl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-(1-pent-4-enoyl-4-piperidyl)pyrazol-3-yl]-piperonylamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C=CCCC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N4O4/c1-2-3-4-20(26)24-11-8-16(9-12-24)25-19(7-10-22-25)23-21(27)15-5-6-17-18(13-15)29-14-28-17/h2,5-7,10,13,16H,1,3-4,8-9,11-12,14H2,(H,23,27)