(1S,6S)-6-(4-ethylpiperazin-1-yl)carbonyl-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6S)-6-(4-ethylpiperazin-1-yl)carbonyl-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6S)-6-(4-ethylpiperazine-1-carbonyl)-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6S)-6-[(4-ethyl-1-piperazinyl)-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6S)-6-(4-ethylpiperazine-1-carbonyl)-3,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6S)-6-(4-ethylpiperazine-1-carbonyl)-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C16H26N2O3 MolecularWeight: 294.38924

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2CC(=C(CC2C(=O)O)C)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)[C@H]2CC(=C(C[C@@H]2C(=O)O)C)C

InChI

InChI=1S/C16H26N2O3/c1-4-17-5-7-18(8-6-17)15(19)13-9-11(2)12(3)10-14(13)16(20)21/h13-14H,4-10H2,1-3H3,(H,20,21)/t13-,14-/m0/s1