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

Systemtic Name: N-[4-[5-(2-azanylethylcarbamoyl)furan-2-yl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[5-(2-aminoethylcarbamoyl)-2-furyl]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[5-[(2-aminoethylamino)-oxomethyl]-2-furanyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[5-(2-aminoethylcarbamoyl)furan-2-yl]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[5-(2-aminoethylcarbamoyl)-2-furyl]phenyl]-piperonylamide Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=C(O4)C(=O)NCCN

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=C(O4)C(=O)NCCN

InChI

InChI=1S/C21H19N3O5/c22-9-10-23-21(26)18-8-7-16(29-18)13-1-4-15(5-2-13)24-20(25)14-3-6-17-19(11-14)28-12-27-17/h1-8,11H,9-10,12,22H2,(H,23,26)(H,24,25)