N-(1,3-benzodioxol-5-ylmethyl)-N-(2-methylpropyl)isoquinoline-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-methylpropyl)isoquinoline-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-isobutyl-isoquinoline-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-methylpropyl)-1-isoquinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-methylpropyl)isoquinoline-1-carboxamide Traditional Name: N-isobutyl-N-piperonyl-isoquinoline-1-carboxamide Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O3/c1-15(2)12-24(13-16-7-8-19-20(11-16)27-14-26-19)22(25)21-18-6-4-3-5-17(18)9-10-23-21/h3-11,15H,12-14H2,1-2H3