15-(1,3-benzodioxol-5-yl)-1-(4-methylpiperazin-1-yl)pentadecan-1-one

Systemtic Name: 15-(1,3-benzodioxol-5-yl)-1-(4-methylpiperazin-1-yl)pentadecan-1-one Openeye Name: 15-(1,3-benzodioxol-5-yl)-1-(4-methylpiperazin-1-yl)pentadecan-1-one CAS Name: 15-(1,3-benzodioxol-5-yl)-1-(4-methyl-1-piperazinyl)-1-pentadecanone IUPAC Name: 15-(1,3-benzodioxol-5-yl)-1-(4-methylpiperazin-1-yl)pentadecan-1-one Traditional Name: 15-(1,3-benzodioxol-5-yl)-1-(4-methylpiperazino)pentadecan-1-one Formula: C27H44N2O3 MolecularWeight: 444.64986

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCCCCCCCCCCCCCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1CCN(CC1)C(=O)CCCCCCCCCCCCCCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C27H44N2O3/c1-28-18-20-29(21-19-28)27(30)15-13-11-9-7-5-3-2-4-6-8-10-12-14-24-16-17-25-26(22-24)32-23-31-25/h16-17,22H,2-15,18-21,23H2,1H3