N-[4-[butyl(furan-2-ylmethyl)amino]-3-(propylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[butyl(furan-2-ylmethyl)amino]-3-(propylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[butyl(2-furylmethyl)amino]-3-(propylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[butyl(2-furanylmethyl)amino]-3-[oxo(propylamino)methyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[butyl(furan-2-ylmethyl)amino]-3-(propylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[butyl(2-furfuryl)amino]-3-(propylcarbamoyl)phenyl]-piperonylamide Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)NCCC

Isomeric SMILES

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)NCCC

InChI

InChI=1S/C27H31N3O5/c1-3-5-13-30(17-21-7-6-14-33-21)23-10-9-20(16-22(23)27(32)28-12-4-2)29-26(31)19-8-11-24-25(15-19)35-18-34-24/h6-11,14-16H,3-5,12-13,17-18H2,1-2H3,(H,28,32)(H,29,31)