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

Systemtic Name: (1S,6S)-6-[4-(3-methoxyphenyl)piperazin-1-yl]carbonylcyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[4-(3-methoxyphenyl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[[4-(3-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[4-(3-methoxyphenyl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[4-(3-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(=C1)N2CCN(CC2)C(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-]

InChI

InChI=1S/C19H24N2O4/c1-25-15-6-4-5-14(13-15)20-9-11-21(12-10-20)18(22)16-7-2-3-8-17(16)19(23)24/h2-6,13,16-17H,7-12H2,1H3,(H,23,24)/p-1/t16-,17-/m0/s1