propan-2-yl 4-[[3-(2-acetamidophenyl)quinoxalin-2-yl]oxymethyl]benzoate

Systemtic Name: propan-2-yl 4-[[3-(2-acetamidophenyl)quinoxalin-2-yl]oxymethyl]benzoate Openeye Name: isopropyl 4-[[3-(2-acetamidophenyl)quinoxalin-2-yl]oxymethyl]benzoate CAS Name: 4-[[3-(2-acetamidophenyl)-2-quinoxalinyl]oxymethyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[3-(2-acetamidophenyl)quinoxalin-2-yl]oxymethyl]benzoate Traditional Name: 4-[[3-(2-acetamidophenyl)quinoxalin-2-yl]oxymethyl]benzoic acid isopropyl ester Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)COC2=NC3=CC=CC=C3N=C2C4=CC=CC=C4NC(=O)C

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)COC2=NC3=CC=CC=C3N=C2C4=CC=CC=C4NC(=O)C

InChI

InChI=1S/C27H25N3O4/c1-17(2)34-27(32)20-14-12-19(13-15-20)16-33-26-25(29-23-10-6-7-11-24(23)30-26)21-8-4-5-9-22(21)28-18(3)31/h4-15,17H,16H2,1-3H3,(H,28,31)