(1S,6R)-6-[4-(2-methoxyphenyl)piperazin-1-yl]carbonylcyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-6-[4-(2-methoxyphenyl)piperazin-1-yl]carbonylcyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-[4-(2-methoxyphenyl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-[4-(2-methoxyphenyl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-[4-(2-methoxyphenyl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylate Formula: C19H23N2O4- MolecularWeight: 343.39692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-]

InChI

InChI=1S/C19H24N2O4/c1-25-17-9-5-4-8-16(17)20-10-12-21(13-11-20)18(22)14-6-2-3-7-15(14)19(23)24/h2-5,8-9,14-15H,6-7,10-13H2,1H3,(H,23,24)/p-1/t14-,15+/m1/s1