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

Systemtic Name: 2-azanyl-N,1-bis(1,3-benzodioxol-5-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N,1-bis(1,3-benzodioxol-5-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N,1-bis(1,3-benzodioxol-5-ylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N,1-bis(1,3-benzodioxol-5-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N,1-dipiperonyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C27H21N5O5 MolecularWeight: 495.48614

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(N(C4=NC5=CC=CC=C5N=C34)CC6=CC7=C(C=C6)OCO7)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(N(C4=NC5=CC=CC=C5N=C34)CC6=CC7=C(C=C6)OCO7)N

InChI

InChI=1S/C27H21N5O5/c28-25-23(27(33)29-11-15-5-7-19-21(9-15)36-13-34-19)24-26(31-18-4-2-1-3-17(18)30-24)32(25)12-16-6-8-20-22(10-16)37-14-35-20/h1-10H,11-14,28H2,(H,29,33)