2-azanyl-1-[(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-[(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[(3-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[(3-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-N-phenethyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[(3-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-N-phenethylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-[(3-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C28H26N6O3 MolecularWeight: 494.54444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC=CC=C5)N)C=CC1=O

Isomeric SMILES

CCOC1=CC(=CNN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC=CC=C5)N)C=CC1=O

InChI

InChI=1S/C28H26N6O3/c1-2-37-23-16-19(12-13-22(23)35)17-31-34-26(29)24(28(36)30-15-14-18-8-4-3-5-9-18)25-27(34)33-21-11-7-6-10-20(21)32-25/h3-13,16-17,31H,2,14-15,29H2,1H3,(H,30,36)