[1-[2-butoxy-4-(dibutylamino)phenyl]-3-oxidanylidene-2-benzofuran-1-yl] ethanoate

Systemtic Name: [1-[2-butoxy-4-(dibutylamino)phenyl]-3-oxidanylidene-2-benzofuran-1-yl] ethanoate Openeye Name: [1-[2-butoxy-4-(dibutylamino)phenyl]-3-oxo-isobenzofuran-1-yl] acetate CAS Name: acetic acid [1-[2-butoxy-4-(dibutylamino)phenyl]-3-oxo-1-isobenzofuranyl] ester IUPAC Name: [1-[2-butoxy-4-(dibutylamino)phenyl]-3-oxo-2-benzofuran-1-yl] acetate Traditional Name: acetic acid [1-[2-butoxy-4-(dibutylamino)phenyl]-3-keto-phthalan-1-yl] ester Formula: C28H37NO5 MolecularWeight: 467.59708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)OC(=O)C)OCCCC

Isomeric SMILES

CCCCN(CCCC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)OC(=O)C)OCCCC

InChI

InChI=1S/C28H37NO5/c1-5-8-17-29(18-9-6-2)22-15-16-25(26(20-22)32-19-10-7-3)28(33-21(4)30)24-14-12-11-13-23(24)27(31)34-28/h11-16,20H,5-10,17-19H2,1-4H3