methyl 2-azanyl-1-(2,4,6-trimethylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: methyl 2-azanyl-1-(2,4,6-trimethylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: methyl 2-amino-1-(2,4,6-trimethylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(2,4,6-trimethylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-1-(2,4,6-trimethylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-mesityl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid methyl ester Formula: C21H20N4O2 MolecularWeight: 360.4091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)OC)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)OC)N)C

InChI

InChI=1S/C21H20N4O2/c1-11-9-12(2)18(13(3)10-11)25-19(22)16(21(26)27-4)17-20(25)24-15-8-6-5-7-14(15)23-17/h5-10H,22H2,1-4H3