1-(4-cyclohexylpiperazin-1-yl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butane-1,4-dione

Systemtic Name: 1-(4-cyclohexylpiperazin-1-yl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butane-1,4-dione Openeye Name: 1-(4-cyclohexylpiperazin-1-yl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butane-1,4-dione CAS Name: 1-(4-cyclohexyl-1-piperazinyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butane-1,4-dione IUPAC Name: 1-(4-cyclohexylpiperazin-1-yl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butane-1,4-dione Traditional Name: 1-(4-cyclohexylpiperazino)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butane-1,4-dione Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)CCC(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)CCC(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H32N2O4/c26-20(18-7-9-21-22(17-18)29-16-4-15-28-21)8-10-23(27)25-13-11-24(12-14-25)19-5-2-1-3-6-19/h7,9,17,19H,1-6,8,10-16H2