diethyl (1S,2S,6R)-2-(4-methoxyphenyl)-6-methyl-6-oxidanyl-4-phenylazanyl-cyclohex-3-ene-1,3-dicarboxylate

Systemtic Name: diethyl (1S,2S,6R)-2-(4-methoxyphenyl)-6-methyl-6-oxidanyl-4-phenylazanyl-cyclohex-3-ene-1,3-dicarboxylate Openeye Name: diethyl (1S,2S,6R)-4-anilino-6-hydroxy-2-(4-methoxyphenyl)-6-methyl-cyclohex-3-ene-1,3-dicarboxylate CAS Name: (1S,2S,6R)-4-anilino-6-hydroxy-2-(4-methoxyphenyl)-6-methylcyclohex-3-ene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl (1S,2S,6R)-4-anilino-6-hydroxy-2-(4-methoxyphenyl)-6-methylcyclohex-3-ene-1,3-dicarboxylate Traditional Name: (1S,2S,6R)-4-anilino-6-hydroxy-2-(4-methoxyphenyl)-6-methyl-cyclohex-3-ene-1,3-dicarboxylic acid diethyl ester Formula: C26H31NO6 MolecularWeight: 453.52744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(CC1(C)O)NC2=CC=CC=C2)C(=O)OCC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)[C@H]1[C@H](C(=C(C[C@@]1(C)O)NC2=CC=CC=C2)C(=O)OCC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H31NO6/c1-5-32-24(28)22-20(27-18-10-8-7-9-11-18)16-26(3,30)23(25(29)33-6-2)21(22)17-12-14-19(31-4)15-13-17/h7-15,21,23,27,30H,5-6,16H2,1-4H3/t21-,23+,26+/m0/s1