2-[(4-butylphenyl)-[2-(phenylcarbonyl)-2,3-dihydro-1-benzofuran-3-yl]amino]-1-phenyl-ethanone

Systemtic Name: 2-[(4-butylphenyl)-[2-(phenylcarbonyl)-2,3-dihydro-1-benzofuran-3-yl]amino]-1-phenyl-ethanone Openeye Name: 2-(N-(2-benzoyl-2,3-dihydrobenzofuran-3-yl)-4-butyl-anilino)-1-phenyl-ethanone CAS Name: 2-(N-(2-benzoyl-2,3-dihydrobenzofuran-3-yl)-4-butylanilino)-1-phenylethanone IUPAC Name: 2-(N-(2-benzoyl-2,3-dihydro-1-benzofuran-3-yl)-4-butylanilino)-1-phenylethanone Traditional Name: 2-(N-(2-benzoylcoumaran-3-yl)-4-butyl-anilino)-1-phenyl-ethanone Formula: C33H31NO3 MolecularWeight: 489.60414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N(CC(=O)C2=CC=CC=C2)C3C(OC4=CC=CC=C34)C(=O)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)N(CC(=O)C2=CC=CC=C2)C3C(OC4=CC=CC=C34)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C33H31NO3/c1-2-3-12-24-19-21-27(22-20-24)34(23-29(35)25-13-6-4-7-14-25)31-28-17-10-11-18-30(28)37-33(31)32(36)26-15-8-5-9-16-26/h4-11,13-22,31,33H,2-3,12,23H2,1H3