13-(4-cyclohexylpiperazin-1-yl)carbonyl-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one

Systemtic Name: 13-(4-cyclohexylpiperazin-1-yl)carbonyl-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one Openeye Name: 13-(4-cyclohexylpiperazine-1-carbonyl)-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one CAS Name: 13-[(4-cyclohexyl-1-piperazinyl)-oxomethyl]-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one IUPAC Name: 13-(4-cyclohexylpiperazine-1-carbonyl)-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one Traditional Name: 13-(4-cyclohexylpiperazine-1-carbonyl)-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinolin-8-one Formula: C28H33N3O2 MolecularWeight: 443.58052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)C3C4C5=CC=CC=C5CCN4C(=O)C6=CC=CC=C36

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)C3C4C5=CC=CC=C5CCN4C(=O)C6=CC=CC=C36

InChI

InChI=1S/C28H33N3O2/c32-27-24-13-7-6-12-23(24)25(26-22-11-5-4-8-20(22)14-15-31(26)27)28(33)30-18-16-29(17-19-30)21-9-2-1-3-10-21/h4-8,11-13,21,25-26H,1-3,9-10,14-19H2