N-(1,3-benzodioxol-5-ylmethyl)-N-butyl-isoquinoline-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-butyl-isoquinoline-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-butyl-isoquinoline-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-butyl-1-isoquinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-butylisoquinoline-1-carboxamide Traditional Name: N-butyl-N-piperonyl-isoquinoline-1-carboxamide Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=NC=CC4=CC=CC=C43

Isomeric SMILES

CCCCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C22H22N2O3/c1-2-3-12-24(14-16-8-9-19-20(13-16)27-15-26-19)22(25)21-18-7-5-4-6-17(18)10-11-23-21/h4-11,13H,2-3,12,14-15H2,1H3