N-(3-azanyl-2,2-dimethyl-propyl)-N-[(4-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(3-azanyl-2,2-dimethyl-propyl)-N-[(4-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-(3-amino-2,2-dimethyl-propyl)-N-[(4-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-(3-amino-2,2-dimethylpropyl)-N-[(4-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(3-amino-2,2-dimethylpropyl)-N-[(4-benzamidophenyl)methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(3-amino-2,2-dimethyl-propyl)-N-(4-benzamidobenzyl)-piperonylamide Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O4/c1-27(2,16-28)17-30(26(32)21-10-13-23-24(14-21)34-18-33-23)15-19-8-11-22(12-9-19)29-25(31)20-6-4-3-5-7-20/h3-14H,15-18,28H2,1-2H3,(H,29,31)