2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)-N-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)-N-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-hexyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-hexylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-hexyl-1-piperonyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C25H27N5O3/c1-2-3-4-7-12-27-25(31)21-22-24(29-18-9-6-5-8-17(18)28-22)30(23(21)26)14-16-10-11-19-20(13-16)33-15-32-19/h5-6,8-11,13H,2-4,7,12,14-15,26H2,1H3,(H,27,31)