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

Systemtic Name: 2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-butoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-butoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-butoxyphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-butoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-butoxyphenyl)-N-piperonyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C29H27N5O4 MolecularWeight: 509.55578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N

InChI

InChI=1S/C29H27N5O4/c1-2-3-14-36-20-11-9-19(10-12-20)34-27(30)25(26-28(34)33-22-7-5-4-6-21(22)32-26)29(35)31-16-18-8-13-23-24(15-18)38-17-37-23/h4-13,15H,2-3,14,16-17,30H2,1H3,(H,31,35)