N-(3-azanyl-2,2-dimethyl-propyl)-N-[[2-chloranyl-5-[(3,4-dimethoxyphenyl)carbonylamino]phenyl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(3-azanyl-2,2-dimethyl-propyl)-N-[[2-chloranyl-5-[(3,4-dimethoxyphenyl)carbonylamino]phenyl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-(3-amino-2,2-dimethyl-propyl)-N-[[2-chloro-5-[(3,4-dimethoxybenzoyl)amino]phenyl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-(3-amino-2,2-dimethylpropyl)-N-[[2-chloro-5-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]phenyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(3-amino-2,2-dimethylpropyl)-N-[[2-chloro-5-[(3,4-dimethoxybenzoyl)amino]phenyl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(3-amino-2,2-dimethyl-propyl)-N-[2-chloro-5-(veratroylamino)benzyl]-piperonylamide Formula: C29H32ClN3O6 MolecularWeight: 554.03388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H32ClN3O6/c1-29(2,15-31)16-33(28(35)19-6-10-24-26(13-19)39-17-38-24)14-20-11-21(7-8-22(20)30)32-27(34)18-5-9-23(36-3)25(12-18)37-4/h5-13H,14-17,31H2,1-4H3,(H,32,34)