1-isoindol-2-yl-6-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)piperazin-1-yl]hexan-1-one

Systemtic Name: 1-isoindol-2-yl-6-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)piperazin-1-yl]hexan-1-one Openeye Name: 1-isoindol-2-yl-6-(4-tetralin-5-ylpiperazin-1-yl)hexan-1-one CAS Name: 1-(2-isoindolyl)-6-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)-1-piperazinyl]-1-hexanone IUPAC Name: 1-isoindol-2-yl-6-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)piperazin-1-yl]hexan-1-one Traditional Name: 1-isoindol-2-yl-6-(4-tetralin-5-ylpiperazino)hexan-1-one Formula: C28H35N3O MolecularWeight: 429.597

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC=C2N3CCN(CC3)CCCCCC(=O)N4C=C5C=CC=CC5=C4

Isomeric SMILES

C1CCC2=C(C1)C=CC=C2N3CCN(CC3)CCCCCC(=O)N4C=C5C=CC=CC5=C4

InChI

InChI=1S/C28H35N3O/c32-28(31-21-24-10-3-4-11-25(24)22-31)15-2-1-7-16-29-17-19-30(20-18-29)27-14-8-12-23-9-5-6-13-26(23)27/h3-4,8,10-12,14,21-22H,1-2,5-7,9,13,15-20H2