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

Systemtic Name: 7-[(3-methyl-4-phenyl-piperazin-1-yl)methyl]-4-propan-2-yl-2-propoxy-cyclohepta-2,4,6-trien-1-one Openeye Name: 4-isopropyl-7-[(3-methyl-4-phenyl-piperazin-1-yl)methyl]-2-propoxy-cyclohepta-2,4,6-trien-1-one CAS Name: 7-[(3-methyl-4-phenyl-1-piperazinyl)methyl]-4-propan-2-yl-2-propoxy-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-[(3-methyl-4-phenylpiperazin-1-yl)methyl]-4-propan-2-yl-2-propoxycyclohepta-2,4,6-trien-1-one Traditional Name: 4-isopropyl-7-[(3-methyl-4-phenyl-piperazino)methyl]-2-propoxy-cyclohepta-2,4,6-trien-1-one Formula: C25H34N2O2 MolecularWeight: 394.54966

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=CC=C(C1=O)CN2CCN(C(C2)C)C3=CC=CC=C3)C(C)C

Isomeric SMILES

CCCOC1=CC(=CC=C(C1=O)CN2CCN(C(C2)C)C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C25H34N2O2/c1-5-15-29-24-16-21(19(2)3)11-12-22(25(24)28)18-26-13-14-27(20(4)17-26)23-9-7-6-8-10-23/h6-12,16,19-20H,5,13-15,17-18H2,1-4H3