2-morpholin-4-yl-7-[(4-phenylpiperazin-1-yl)methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-morpholin-4-yl-7-[(4-phenylpiperazin-1-yl)methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 4-isopropyl-2-morpholino-7-[(4-phenylpiperazin-1-yl)methyl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-(4-morpholinyl)-7-[(4-phenyl-1-piperazinyl)methyl]-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-morpholin-4-yl-7-[(4-phenylpiperazin-1-yl)methyl]-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 4-isopropyl-2-morpholino-7-[(4-phenylpiperazino)methyl]cyclohepta-2,4,6-trien-1-one Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C(=O)C(=C1)N2CCOCC2)CN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C(=O)C(=C1)N2CCOCC2)CN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3O2/c1-20(2)21-8-9-22(25(29)24(18-21)28-14-16-30-17-15-28)19-26-10-12-27(13-11-26)23-6-4-3-5-7-23/h3-9,18,20H,10-17,19H2,1-2H3