2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-bromophenyl)-N-piperonyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H18BrN5O3 MolecularWeight: 516.34612

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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)C6=CC=C(C=C6)Br)N

Isomeric SMILES

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

InChI

InChI=1S/C25H18BrN5O3/c26-15-6-8-16(9-7-15)31-23(27)21(22-24(31)30-18-4-2-1-3-17(18)29-22)25(32)28-12-14-5-10-19-20(11-14)34-13-33-19/h1-11H,12-13,27H2,(H,28,32)