2-methylpropyl 2-azanyl-1-(3-chloranyl-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: 2-methylpropyl 2-azanyl-1-(3-chloranyl-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: isobutyl 2-amino-1-(3-chloro-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(3-chloro-4-methylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-amino-1-(3-chloro-4-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(3-chloro-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid isobutyl ester Formula: C22H21ClN4O2 MolecularWeight: 408.88074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClN4O2/c1-12(2)11-29-22(28)18-19-21(26-17-7-5-4-6-16(17)25-19)27(20(18)24)14-9-8-13(3)15(23)10-14/h4-10,12H,11,24H2,1-3H3