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

Systemtic Name: methyl 2-azanyl-1-(4-butan-2-ylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: methyl 2-amino-1-(4-sec-butylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(4-butan-2-ylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-1-(4-butan-2-ylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(4-sec-butylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid methyl ester Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O2/c1-4-13(2)14-9-11-15(12-10-14)26-20(23)18(22(27)28-3)19-21(26)25-17-8-6-5-7-16(17)24-19/h5-13H,4,23H2,1-3H3