N-(2-azanylethyl)-1-(1,3-benzodioxol-5-ylcarbonyl)-3-(3,4-dichlorophenyl)carbonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(1,3-benzodioxol-5-ylcarbonyl)-3-(3,4-dichlorophenyl)carbonyl-imidazolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(1,3-benzodioxole-5-carbonyl)-3-(3,4-dichlorobenzoyl)imidazolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[1,3-benzodioxol-5-yl(oxo)methyl]-3-[(3,4-dichlorophenyl)-oxomethyl]-2-imidazolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(1,3-benzodioxole-5-carbonyl)-3-(3,4-dichlorobenzoyl)imidazolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(3,4-dichlorobenzoyl)-3-piperonyloyl-imidazolidine-2-carboxamide Formula: C21H20Cl2N4O5 MolecularWeight: 479.3133

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N1C(=O)C2=CC3=C(C=C2)OCO3)C(=O)NCCN)C(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(C(N1C(=O)C2=CC3=C(C=C2)OCO3)C(=O)NCCN)C(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H20Cl2N4O5/c22-14-3-1-12(9-15(14)23)20(29)26-7-8-27(19(26)18(28)25-6-5-24)21(30)13-2-4-16-17(10-13)32-11-31-16/h1-4,9-10,19H,5-8,11,24H2,(H,25,28)