N-(3-azanyl-2,2-dimethyl-propyl)-N-[[3-(2-phenoxyethanoylamino)phenyl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(3-azanyl-2,2-dimethyl-propyl)-N-[[3-(2-phenoxyethanoylamino)phenyl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-(3-amino-2,2-dimethyl-propyl)-N-[[3-[(2-phenoxyacetyl)amino]phenyl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-(3-amino-2,2-dimethylpropyl)-N-[[3-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(3-amino-2,2-dimethylpropyl)-N-[[3-[(2-phenoxyacetyl)amino]phenyl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(3-amino-2,2-dimethyl-propyl)-N-[3-[(2-phenoxyacetyl)amino]benzyl]-piperonylamide Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CN(CC1=CC(=CC=C1)NC(=O)COC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(CN)CN(CC1=CC(=CC=C1)NC(=O)COC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C28H31N3O5/c1-28(2,17-29)18-31(27(33)21-11-12-24-25(14-21)36-19-35-24)15-20-7-6-8-22(13-20)30-26(32)16-34-23-9-4-3-5-10-23/h3-14H,15-19,29H2,1-2H3,(H,30,32)