11-butyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-9-(oxan-4-ylmethyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride

Systemtic Name: 11-butyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-9-(oxan-4-ylmethyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride Openeye Name: 11-butyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-9-(tetrahydropyran-4-ylmethyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride CAS Name: 11-butyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-9-(4-oxanylmethyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride IUPAC Name: 11-butyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-9-(oxan-4-ylmethyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride Traditional Name: 11-butyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-9-(tetrahydropyran-4-ylmethyl)-3,8,11-triazaspiro[5.5]undecane-7,10-quinone hydrochloride Formula: C27H40ClN3O5 MolecularWeight: 522.0766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(NC(=O)C12CCN(CC2)CC3=CC4=C(C=C3)OCCO4)CC5CCOCC5.Cl

Isomeric SMILES

CCCCN1C(=O)C(NC(=O)C12CCN(CC2)CC3=CC4=C(C=C3)OCCO4)CC5CCOCC5.Cl

InChI

InChI=1S/C27H39N3O5.ClH/c1-2-3-10-30-25(31)22(17-20-6-13-33-14-7-20)28-26(32)27(30)8-11-29(12-9-27)19-21-4-5-23-24(18-21)35-16-15-34-23;/h4-5,18,20,22H,2-3,6-17,19H2,1H3,(H,28,32);1H