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

Systemtic Name: 2-methylpropyl 2-azanyl-1-(3-chloranyl-4-methoxy-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: isobutyl 2-amino-1-(3-chloro-4-methoxy-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(3-chloro-4-methoxyphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-amino-1-(3-chloro-4-methoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(3-chloro-4-methoxy-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid isobutyl ester Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)OC)Cl)N

Isomeric SMILES

CC(C)COC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)OC)Cl)N

InChI

InChI=1S/C22H21ClN4O3/c1-12(2)11-30-22(28)18-19-21(26-16-7-5-4-6-15(16)25-19)27(20(18)24)13-8-9-17(29-3)14(23)10-13/h4-10,12H,11,24H2,1-3H3