[1,7-bis[2-(cyclohexylamino)phenyl]-3-oxidanylidene-2-benzofuran-1-yl] ethanoate

Systemtic Name: [1,7-bis[2-(cyclohexylamino)phenyl]-3-oxidanylidene-2-benzofuran-1-yl] ethanoate Openeye Name: [1,7-bis[2-(cyclohexylamino)phenyl]-3-oxo-isobenzofuran-1-yl] acetate CAS Name: acetic acid [1,7-bis[2-(cyclohexylamino)phenyl]-3-oxo-1-isobenzofuranyl] ester IUPAC Name: [1,7-bis[2-(cyclohexylamino)phenyl]-3-oxo-2-benzofuran-1-yl] acetate Traditional Name: acetic acid [1,7-bis[2-(cyclohexylamino)phenyl]-3-keto-phthalan-1-yl] ester Formula: C34H38N2O4 MolecularWeight: 538.67652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C2=C(C=CC=C2C(=O)O1)C3=CC=CC=C3NC4CCCCC4)C5=CC=CC=C5NC6CCCCC6

Isomeric SMILES

CC(=O)OC1(C2=C(C=CC=C2C(=O)O1)C3=CC=CC=C3NC4CCCCC4)C5=CC=CC=C5NC6CCCCC6

InChI

InChI=1S/C34H38N2O4/c1-23(37)39-34(29-20-9-11-22-31(29)36-25-15-6-3-7-16-25)32-27(18-12-19-28(32)33(38)40-34)26-17-8-10-21-30(26)35-24-13-4-2-5-14-24/h8-12,17-22,24-25,35-36H,2-7,13-16H2,1H3