tert-butyl 2-azanyl-1-(4-hydroxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: tert-butyl 2-azanyl-1-(4-hydroxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: tert-butyl 2-amino-1-(4-hydroxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(4-hydroxyphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-1-(4-hydroxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(4-hydroxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid tert-butyl ester Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O3/c1-21(2,3)28-20(27)16-17-19(24-15-7-5-4-6-14(15)23-17)25(18(16)22)12-8-10-13(26)11-9-12/h4-11,26H,22H2,1-3H3