1-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-2-(4-methylphenoxy)ethanone; ethanedioic acid

Systemtic Name: 1-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-2-(4-methylphenoxy)ethanone; ethanedioic acid Openeye Name: 1-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-2-(4-methylphenoxy)ethanone; oxalic acid CAS Name: 1-[4-(1-cyclohex-3-enylmethyl)-1-piperazinyl]-2-(4-methylphenoxy)ethanone; oxalic acid IUPAC Name: 1-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-2-(4-methylphenoxy)ethanone; oxalic acid Traditional Name: 1-[4-(cyclohex-3-en-1-ylmethyl)piperazino]-2-(4-methylphenoxy)ethanone; oxalic acid Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(=O)N2CCN(CC2)CC3CCC=CC3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)OCC(=O)N2CCN(CC2)CC3CCC=CC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H28N2O2.C2H2O4/c1-17-7-9-19(10-8-17)24-16-20(23)22-13-11-21(12-14-22)15-18-5-3-2-4-6-18;3-1(4)2(5)6/h2-3,7-10,18H,4-6,11-16H2,1H3;(H,3,4)(H,5,6)