5-oxidanylidene-5-[4-(2,4,5-trimethylphenyl)piperazin-1-yl]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[4-(2,4,5-trimethylphenyl)piperazin-1-yl]pentanoic acid Openeye Name: 5-oxo-5-[4-(2,4,5-trimethylphenyl)piperazin-1-yl]pentanoic acid CAS Name: 5-oxo-5-[4-(2,4,5-trimethylphenyl)-1-piperazinyl]pentanoic acid IUPAC Name: 5-oxo-5-[4-(2,4,5-trimethylphenyl)piperazin-1-yl]pentanoic acid Traditional Name: 5-keto-5-[4-(2,4,5-trimethylphenyl)piperazino]valeric acid Formula: C18H26N2O3 MolecularWeight: 318.41064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)N2CCN(CC2)C(=O)CCCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1C)N2CCN(CC2)C(=O)CCCC(=O)O)C

InChI

InChI=1S/C18H26N2O3/c1-13-11-15(3)16(12-14(13)2)19-7-9-20(10-8-19)17(21)5-4-6-18(22)23/h11-12H,4-10H2,1-3H3,(H,22,23)