[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-(4-methoxyphenyl)methanone; ethanedioic acid

Systemtic Name: [4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-(4-methoxyphenyl)methanone; ethanedioic acid Openeye Name: [4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-(4-methoxyphenyl)methanone; oxalic acid CAS Name: [4-(1-cyclohex-3-enylmethyl)-1-piperazinyl]-(4-methoxyphenyl)methanone; oxalic acid IUPAC Name: [4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-(4-methoxyphenyl)methanone; oxalic acid Traditional Name: [4-(cyclohex-3-en-1-ylmethyl)piperazino]-(4-methoxyphenyl)methanone; oxalic acid Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3CCC=CC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3CCC=CC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H26N2O2.C2H2O4/c1-23-18-9-7-17(8-10-18)19(22)21-13-11-20(12-14-21)15-16-5-3-2-4-6-16;3-1(4)2(5)6/h2-3,7-10,16H,4-6,11-15H2,1H3;(H,3,4)(H,5,6)