ethyl 4-[[1-[4-(diethylamino)phenyl]-3-oxidanylidene-2-benzofuran-1-yl]amino]benzoate

Systemtic Name: ethyl 4-[[1-[4-(diethylamino)phenyl]-3-oxidanylidene-2-benzofuran-1-yl]amino]benzoate Openeye Name: ethyl 4-[[1-[4-(diethylamino)phenyl]-3-oxo-isobenzofuran-1-yl]amino]benzoate CAS Name: 4-[[1-[4-(diethylamino)phenyl]-3-oxo-1-isobenzofuranyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-[4-(diethylamino)phenyl]-3-oxo-2-benzofuran-1-yl]amino]benzoate Traditional Name: 4-[[1-[4-(diethylamino)phenyl]-3-keto-phthalan-1-yl]amino]benzoic acid ethyl ester Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)NC4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)NC4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C27H28N2O4/c1-4-29(5-2)22-17-13-20(14-18-22)27(24-10-8-7-9-23(24)26(31)33-27)28-21-15-11-19(12-16-21)25(30)32-6-3/h7-18,28H,4-6H2,1-3H3