[4,6-ditert-butyl-2-[[carbamimidoyl(phenyl)amino]oxymethyl]-2-methyl-3H-1-benzofuran-5-yl] ethanoate

Systemtic Name: [4,6-ditert-butyl-2-[[carbamimidoyl(phenyl)amino]oxymethyl]-2-methyl-3H-1-benzofuran-5-yl] ethanoate Openeye Name: [4,6-ditert-butyl-2-[(N-carbamimidoylanilino)oxymethyl]-2-methyl-3H-benzofuran-5-yl] acetate CAS Name: acetic acid [4,6-ditert-butyl-2-[(N-carbamimidoylanilino)oxymethyl]-2-methyl-3H-benzofuran-5-yl] ester IUPAC Name: [4,6-ditert-butyl-2-[(N-carbamimidoylanilino)oxymethyl]-2-methyl-3H-1-benzofuran-5-yl] acetate Traditional Name: acetic acid [2-[(N-amidinoanilino)oxymethyl]-4,6-ditert-butyl-2-methyl-coumaran-5-yl] ester Formula: C27H37N3O4 MolecularWeight: 467.60038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C2=C(C=C1C(C)(C)C)OC(C2)(C)CON(C3=CC=CC=C3)C(=N)N)C(C)(C)C

Isomeric SMILES

CC(=O)OC1=C(C2=C(C=C1C(C)(C)C)OC(C2)(C)CON(C3=CC=CC=C3)C(=N)N)C(C)(C)C

InChI

InChI=1S/C27H37N3O4/c1-17(31)33-23-20(25(2,3)4)14-21-19(22(23)26(5,6)7)15-27(8,34-21)16-32-30(24(28)29)18-12-10-9-11-13-18/h9-14H,15-16H2,1-8H3,(H3,28,29)