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

Systemtic Name: butan-2-yl 2-azanyl-1-(4-phenoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: sec-butyl 2-amino-1-(4-phenoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(4-phenoxyphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-amino-1-(4-phenoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(4-phenoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid sec-butyl ester Formula: C27H24N4O3 MolecularWeight: 452.50446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)OC5=CC=CC=C5)N

Isomeric SMILES

CCC(C)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)OC5=CC=CC=C5)N

InChI

InChI=1S/C27H24N4O3/c1-3-17(2)33-27(32)23-24-26(30-22-12-8-7-11-21(22)29-24)31(25(23)28)18-13-15-20(16-14-18)34-19-9-5-4-6-10-19/h4-17H,3,28H2,1-2H3