2-ethoxy-7-[[4-(3-fluorophenyl)piperazin-1-yl]methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-ethoxy-7-[[4-(3-fluorophenyl)piperazin-1-yl]methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-ethoxy-7-[[4-(3-fluorophenyl)piperazin-1-yl]methyl]-4-isopropyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-ethoxy-7-[[4-(3-fluorophenyl)-1-piperazinyl]methyl]-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-ethoxy-7-[[4-(3-fluorophenyl)piperazin-1-yl]methyl]-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-ethoxy-7-[[4-(3-fluorophenyl)piperazino]methyl]-4-isopropyl-cyclohepta-2,4,6-trien-1-one Formula: C23H29FN2O2 MolecularWeight: 384.486963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC=C(C1=O)CN2CCN(CC2)C3=CC(=CC=C3)F)C(C)C

Isomeric SMILES

CCOC1=CC(=CC=C(C1=O)CN2CCN(CC2)C3=CC(=CC=C3)F)C(C)C

InChI

InChI=1S/C23H29FN2O2/c1-4-28-22-14-18(17(2)3)8-9-19(23(22)27)16-25-10-12-26(13-11-25)21-7-5-6-20(24)15-21/h5-9,14-15,17H,4,10-13,16H2,1-3H3