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

Systemtic Name: butan-2-yl 2-azanyl-1-(4-phenylmethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: sec-butyl 2-amino-1-(4-benzyloxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(4-phenylmethoxyphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-amino-1-(4-phenylmethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(4-benzoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid sec-butyl ester Formula: C28H26N4O3 MolecularWeight: 466.53104

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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)OCC5=CC=CC=C5)N

Isomeric SMILES

CCC(C)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)OCC5=CC=CC=C5)N

InChI

InChI=1S/C28H26N4O3/c1-3-18(2)35-28(33)24-25-27(31-23-12-8-7-11-22(23)30-25)32(26(24)29)20-13-15-21(16-14-20)34-17-19-9-5-4-6-10-19/h4-16,18H,3,17,29H2,1-2H3