(3-chloranyl-1-adamantyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-1-adamantyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone Openeye Name: (3-chloro-1-adamantyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone CAS Name: (3-chloro-1-adamantyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (3-chloro-1-adamantyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone Traditional Name: (3-chloro-1-adamantyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]methanone Formula: C24H31ClN2O3 MolecularWeight: 430.96754

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)C(=O)C45CC6CC(C4)CC(C6)(C5)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)C(=O)C45CC6CC(C4)CC(C6)(C5)Cl

InChI

InChI=1S/C24H31ClN2O3/c25-24-13-18-9-19(14-24)12-23(11-18,16-24)22(28)27-5-3-26(4-6-27)15-17-1-2-20-21(10-17)30-8-7-29-20/h1-2,10,18-19H,3-9,11-16H2