[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: [2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: [2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl] 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid [2-(2-ethyl-6-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethyl-6-methylanilino)-2-oxoethyl] 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid [2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl] ester Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)COC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)COC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3)C

InChI

InChI=1S/C25H23NO4/c1-3-17-9-6-7-16(2)25(17)26-22(27)15-30-23(28)13-19-14-29-21-12-11-18-8-4-5-10-20(18)24(19)21/h4-12,14H,3,13,15H2,1-2H3,(H,26,27)