dimethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6-methyl-6-oxidanyl-2-phenyl-cyclohex-3-ene-1,3-dicarboxylate

Systemtic Name: dimethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6-methyl-6-oxidanyl-2-phenyl-cyclohex-3-ene-1,3-dicarboxylate Openeye Name: dimethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6-hydroxy-6-methyl-2-phenyl-cyclohex-3-ene-1,3-dicarboxylate CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6-hydroxy-6-methyl-2-phenylcyclohex-3-ene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6-hydroxy-6-methyl-2-phenylcyclohex-3-ene-1,3-dicarboxylate Traditional Name: 4-(homoveratrylamino)-6-hydroxy-6-methyl-2-phenyl-cyclohex-3-ene-1,3-dicarboxylic acid dimethyl ester Formula: C27H33NO7 MolecularWeight: 483.55342

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(C1C(=O)OC)C2=CC=CC=C2)C(=O)OC)NCCC3=CC(=C(C=C3)OC)OC)O

Isomeric SMILES

CC1(CC(=C(C(C1C(=O)OC)C2=CC=CC=C2)C(=O)OC)NCCC3=CC(=C(C=C3)OC)OC)O

InChI

InChI=1S/C27H33NO7/c1-27(31)16-19(28-14-13-17-11-12-20(32-2)21(15-17)33-3)23(25(29)34-4)22(24(27)26(30)35-5)18-9-7-6-8-10-18/h6-12,15,22,24,28,31H,13-14,16H2,1-5H3