(4-cyclohexylpiperazin-1-yl)-(3-methoxyphenyl)methanone; ethanedioic acid

Systemtic Name: (4-cyclohexylpiperazin-1-yl)-(3-methoxyphenyl)methanone; ethanedioic acid Openeye Name: (4-cyclohexylpiperazin-1-yl)-(3-methoxyphenyl)methanone; oxalic acid CAS Name: (4-cyclohexyl-1-piperazinyl)-(3-methoxyphenyl)methanone; oxalic acid IUPAC Name: (4-cyclohexylpiperazin-1-yl)-(3-methoxyphenyl)methanone; oxalic acid Traditional Name: (4-cyclohexylpiperazino)-(3-methoxyphenyl)methanone; oxalic acid Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3CCCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3CCCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H26N2O2.C2H2O4/c1-22-17-9-5-6-15(14-17)18(21)20-12-10-19(11-13-20)16-7-3-2-4-8-16;3-1(4)2(5)6/h5-6,9,14,16H,2-4,7-8,10-13H2,1H3;(H,3,4)(H,5,6)