N-(4-azanylcyclohexyl)-N-[(3-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[(3-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-(4-aminocyclohexyl)-N-[(3-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-(4-aminocyclohexyl)-N-[(3-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-N-[(3-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(4-aminocyclohexyl)-N-(3-benzamidobenzyl)-piperonylamide Formula: C28H29N3O4 MolecularWeight: 471.54756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC(=CC=C2)NC(=O)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC(=CC=C2)NC(=O)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H29N3O4/c29-22-10-12-24(13-11-22)31(28(33)21-9-14-25-26(16-21)35-18-34-25)17-19-5-4-8-23(15-19)30-27(32)20-6-2-1-3-7-20/h1-9,14-16,22,24H,10-13,17-18,29H2,(H,30,32)