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

Systemtic Name: 2-azanyl-N-[(2,3-dimethoxyphenyl)methyl]-1-(4-iodophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-[(2,3-dimethoxyphenyl)methyl]-1-(4-iodophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-[(2,3-dimethoxyphenyl)methyl]-1-(4-iodophenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-[(2,3-dimethoxyphenyl)methyl]-1-(4-iodophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-iodophenyl)-N-o-veratryl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C26H22IN5O3 MolecularWeight: 579.38905

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC=C(C=C5)I)N

Isomeric SMILES

COC1=CC=CC(=C1OC)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC=C(C=C5)I)N

InChI

InChI=1S/C26H22IN5O3/c1-34-20-9-5-6-15(23(20)35-2)14-29-26(33)21-22-25(31-19-8-4-3-7-18(19)30-22)32(24(21)28)17-12-10-16(27)11-13-17/h3-13H,14,28H2,1-2H3,(H,29,33)