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

Systemtic Name: N-[4-[5-[(4-azanylcyclohexyl)carbamoyl]furan-2-yl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[5-[(4-aminocyclohexyl)carbamoyl]-2-furyl]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[5-[[(4-aminocyclohexyl)amino]-oxomethyl]-2-furanyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[5-[(4-aminocyclohexyl)carbamoyl]furan-2-yl]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[5-[(4-aminocyclohexyl)carbamoyl]-2-furyl]phenyl]-piperonylamide Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H25N3O5/c26-17-4-8-19(9-5-17)28-25(30)22-12-11-20(33-22)15-1-6-18(7-2-15)27-24(29)16-3-10-21-23(13-16)32-14-31-21/h1-3,6-7,10-13,17,19H,4-5,8-9,14,26H2,(H,27,29)(H,28,30)