6-[3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propylcarbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[3-[4-(2-isopropoxyphenyl)piperazin-1-yl]propylcarbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[oxo-[3-[4-(2-propan-2-yloxyphenyl)-1-piperazinyl]propylamino]methyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[3-[4-(2-isopropoxyphenyl)piperazino]propylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C24H35N3O4 MolecularWeight: 429.5524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1N2CCN(CC2)CCCNC(=O)C3CC=CCC3C(=O)O

Isomeric SMILES

CC(C)OC1=CC=CC=C1N2CCN(CC2)CCCNC(=O)C3CC=CCC3C(=O)O

InChI

InChI=1S/C24H35N3O4/c1-18(2)31-22-11-6-5-10-21(22)27-16-14-26(15-17-27)13-7-12-25-23(28)19-8-3-4-9-20(19)24(29)30/h3-6,10-11,18-20H,7-9,12-17H2,1-2H3,(H,25,28)(H,29,30)