N-[5-(2-azanylethylcarbamoyl)-2-chloranyl-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[5-(2-azanylethylcarbamoyl)-2-chloranyl-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[5-(2-aminoethylcarbamoyl)-2-chloro-phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[5-[(2-aminoethylamino)-oxomethyl]-2-chlorophenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[5-(2-aminoethylcarbamoyl)-2-chlorophenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[5-(2-aminoethylcarbamoyl)-2-chloro-phenyl]-piperonylamide Formula: C17H16ClN3O4 MolecularWeight: 361.77964

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)NCCN)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)NCCN)Cl

InChI

InChI=1S/C17H16ClN3O4/c18-12-3-1-10(16(22)20-6-5-19)7-13(12)21-17(23)11-2-4-14-15(8-11)25-9-24-14/h1-4,7-8H,5-6,9,19H2,(H,20,22)(H,21,23)