(1R,6S)-6-[(3,4-dimethoxyphenyl)methylcarbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[(3,4-dimethoxyphenyl)methylcarbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[(3,4-dimethoxyphenyl)methylcarbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[(3,4-dimethoxyphenyl)methylamino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[(3,4-dimethoxyphenyl)methylcarbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-3,4-dimethyl-6-(veratrylcarbamoyl)cyclohex-3-ene-1-carboxylate Formula: C19H24NO5- MolecularWeight: 346.39756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NCC2=CC(=C(C=C2)OC)OC)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)NCC2=CC(=C(C=C2)OC)OC)C(=O)[O-])C

InChI

InChI=1S/C19H25NO5/c1-11-7-14(15(19(22)23)8-12(11)2)18(21)20-10-13-5-6-16(24-3)17(9-13)25-4/h5-6,9,14-15H,7-8,10H2,1-4H3,(H,20,21)(H,22,23)/p-1/t14-,15+/m0/s1