7-chloranyl-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: 7-chloranyl-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: 7-chloro-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: 7-chloro-N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: 7-chloro-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: 7-chloro-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-piperonylamide Formula: C21H23ClN4O3 MolecularWeight: 414.88532

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C21H23ClN4O3/c1-3-25(4-2)9-10-26-17-8-6-5-7-16(17)23-21(26)24-20(27)14-11-15(22)19-18(12-14)28-13-29-19/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,23,24,27)