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

Systemtic Name: 2-azanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-dodecyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-dodecyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-dodecyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-dodecylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-homoveratryl-1-lauryl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C33H45N5O3 MolecularWeight: 559.7421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NCCC4=CC(=C(C=C4)OC)OC)N

Isomeric SMILES

CCCCCCCCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NCCC4=CC(=C(C=C4)OC)OC)N

InChI

InChI=1S/C33H45N5O3/c1-4-5-6-7-8-9-10-11-12-15-22-38-31(34)29(30-32(38)37-26-17-14-13-16-25(26)36-30)33(39)35-21-20-24-18-19-27(40-2)28(23-24)41-3/h13-14,16-19,23H,4-12,15,20-22,34H2,1-3H3,(H,35,39)