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

Systemtic Name: 7-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-4-propan-2-yl-2-propoxy-cyclohepta-2,4,6-trien-1-one Openeye Name: 4-isopropyl-7-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-2-propoxy-cyclohepta-2,4,6-trien-1-one CAS Name: 7-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-4-propan-2-yl-2-propoxy-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-4-propan-2-yl-2-propoxycyclohepta-2,4,6-trien-1-one Traditional Name: 4-isopropyl-7-[[4-(2-methoxyphenyl)piperazino]methyl]-2-propoxy-cyclohepta-2,4,6-trien-1-one Formula: C25H34N2O3 MolecularWeight: 410.54906

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=CC=C(C1=O)CN2CCN(CC2)C3=CC=CC=C3OC)C(C)C

Isomeric SMILES

CCCOC1=CC(=CC=C(C1=O)CN2CCN(CC2)C3=CC=CC=C3OC)C(C)C

InChI

InChI=1S/C25H34N2O3/c1-5-16-30-24-17-20(19(2)3)10-11-21(25(24)28)18-26-12-14-27(15-13-26)22-8-6-7-9-23(22)29-4/h6-11,17,19H,5,12-16,18H2,1-4H3