(4-methanoylphenyl)carbonyloxymethyl 3-[2-(1-benzofuran-2-ylmethoxycarbonylamino)-2-methyl-3-oxidanylidene-3-(1-phenylethylamino)propyl]indole-1-carboxylate

Systemtic Name: (4-methanoylphenyl)carbonyloxymethyl 3-[2-(1-benzofuran-2-ylmethoxycarbonylamino)-2-methyl-3-oxidanylidene-3-(1-phenylethylamino)propyl]indole-1-carboxylate Openeye Name: (4-formylbenzoyl)oxymethyl 3-[2-(benzofuran-2-ylmethoxycarbonylamino)-2-methyl-3-oxo-3-(1-phenylethylamino)propyl]indole-1-carboxylate CAS Name: 3-[2-[[2-benzofuranylmethoxy(oxo)methyl]amino]-2-methyl-3-oxo-3-(1-phenylethylamino)propyl]-1-indolecarboxylic acid [(4-formylphenyl)-oxomethoxy]methyl ester IUPAC Name: (4-formylbenzoyl)oxymethyl 3-[2-(1-benzofuran-2-ylmethoxycarbonylamino)-2-methyl-3-oxo-3-(1-phenylethylamino)propyl]indole-1-carboxylate Traditional Name: 3-[2-(benzofuran-2-ylmethoxycarbonylamino)-3-keto-2-methyl-3-(1-phenylethylamino)propyl]indole-1-carboxylic acid (4-formylbenzoyl)oxymethyl ester Formula: C40H35N3O9 MolecularWeight: 701.7206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(C)(CC2=CN(C3=CC=CC=C32)C(=O)OCOC(=O)C4=CC=C(C=C4)C=O)NC(=O)OCC5=CC6=CC=CC=C6O5

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C(C)(CC2=CN(C3=CC=CC=C32)C(=O)OCOC(=O)C4=CC=C(C=C4)C=O)NC(=O)OCC5=CC6=CC=CC=C6O5

InChI

InChI=1S/C40H35N3O9/c1-26(28-10-4-3-5-11-28)41-37(46)40(2,42-38(47)49-24-32-20-30-12-6-9-15-35(30)52-32)21-31-22-43(34-14-8-7-13-33(31)34)39(48)51-25-50-36(45)29-18-16-27(23-44)17-19-29/h3-20,22-23,26H,21,24-25H2,1-2H3,(H,41,46)(H,42,47)