2-azanyl-N,1-bis(3,4-dimethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N,1-bis(3,4-dimethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N,1-bis(3,4-dimethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N,1-bis(3,4-dimethoxyphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N,1-bis(3,4-dimethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N,1-bis(3,4-dimethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C27H25N5O5 MolecularWeight: 499.5179

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC(=C(C=C5)OC)OC)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC(=C(C=C5)OC)OC)N)OC

InChI

InChI=1S/C27H25N5O5/c1-34-19-11-9-15(13-21(19)36-3)29-27(33)23-24-26(31-18-8-6-5-7-17(18)30-24)32(25(23)28)16-10-12-20(35-2)22(14-16)37-4/h5-14H,28H2,1-4H3,(H,29,33)