N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)-2-methyl-phenyl]-piperonylamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H25N3O3/c1-3-23-8-10-24(11-9-23)17-5-6-18(15(2)12-17)22-21(25)16-4-7-19-20(13-16)27-14-26-19/h4-7,12-13H,3,8-11,14H2,1-2H3,(H,22,25)