N-(3-azanylpropyl)-N-[[3-(3-azanyl-4-pyrrolidin-1-yl-phenyl)phenyl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(3-azanylpropyl)-N-[[3-(3-azanyl-4-pyrrolidin-1-yl-phenyl)phenyl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-(3-aminopropyl)-N-[[3-(3-amino-4-pyrrolidin-1-yl-phenyl)phenyl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-(3-aminopropyl)-N-[[3-[3-amino-4-(1-pyrrolidinyl)phenyl]phenyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(3-aminopropyl)-N-[[3-(3-amino-4-pyrrolidin-1-ylphenyl)phenyl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(3-aminopropyl)-N-[3-(3-amino-4-pyrrolidino-phenyl)benzyl]-piperonylamide Formula: C28H32N4O3 MolecularWeight: 472.57868

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(CCCN)C(=O)C4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(CCCN)C(=O)C4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C28H32N4O3/c29-11-4-14-32(28(33)23-8-10-26-27(17-23)35-19-34-26)18-20-5-3-6-21(15-20)22-7-9-25(24(30)16-22)31-12-1-2-13-31/h3,5-10,15-17H,1-2,4,11-14,18-19,29-30H2