N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(oxolan-2-ylmethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(oxolan-2-ylmethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(tetrahydrofuran-2-ylmethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo-(2-oxolanylmethylamino)methyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(oxolan-2-ylmethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(tetrahydrofurfurylcarbamoyl)phenyl]-piperonylamide Formula: C29H29N3O5 MolecularWeight: 499.55766

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4)N5CCC6=CC=CC=C6C5

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C29H29N3O5/c33-28(20-7-10-26-27(14-20)37-18-36-26)31-22-8-9-25(32-12-11-19-4-1-2-5-21(19)17-32)24(15-22)29(34)30-16-23-6-3-13-35-23/h1-2,4-5,7-10,14-15,23H,3,6,11-13,16-18H2,(H,30,34)(H,31,33)