N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-2-oxo-1-phenyl-ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[2-(cyclohexylamino)-2-keto-1-phenyl-ethyl]-N-piperonyl-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C31H32N2O6 MolecularWeight: 528.59558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(CC3=CC4=C(C=C3)OCO4)C(=O)C5COC6=CC=CC=C6O5

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(CC3=CC4=C(C=C3)OCO4)C(=O)C5COC6=CC=CC=C6O5

InChI

InChI=1S/C31H32N2O6/c34-30(32-23-11-5-2-6-12-23)29(22-9-3-1-4-10-22)33(18-21-15-16-25-27(17-21)38-20-37-25)31(35)28-19-36-24-13-7-8-14-26(24)39-28/h1,3-4,7-10,13-17,23,28-29H,2,5-6,11-12,18-20H2,(H,32,34)