(3,3,5,5-tetramethylcyclohexyl) 3-[(3-methoxy-4-oxidanyl-phenyl)methylcarbamoyl]azetidine-1-carboxylate

Systemtic Name: (3,3,5,5-tetramethylcyclohexyl) 3-[(3-methoxy-4-oxidanyl-phenyl)methylcarbamoyl]azetidine-1-carboxylate Openeye Name: (3,3,5,5-tetramethylcyclohexyl) 3-[(4-hydroxy-3-methoxy-phenyl)methylcarbamoyl]azetidine-1-carboxylate CAS Name: 3-[[(4-hydroxy-3-methoxyphenyl)methylamino]-oxomethyl]-1-azetidinecarboxylic acid (3,3,5,5-tetramethylcyclohexyl) ester IUPAC Name: (3,3,5,5-tetramethylcyclohexyl) 3-[(4-hydroxy-3-methoxyphenyl)methylcarbamoyl]azetidine-1-carboxylate Traditional Name: 3-(vanillylcarbamoyl)azetidine-1-carboxylic acid (3,3,5,5-tetramethylcyclohexyl) ester Formula: C23H34N2O5 MolecularWeight: 418.52646

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)C)OC(=O)N2CC(C2)C(=O)NCC3=CC(=C(C=C3)O)OC)C

Isomeric SMILES

CC1(CC(CC(C1)(C)C)OC(=O)N2CC(C2)C(=O)NCC3=CC(=C(C=C3)O)OC)C

InChI

InChI=1S/C23H34N2O5/c1-22(2)9-17(10-23(3,4)14-22)30-21(28)25-12-16(13-25)20(27)24-11-15-6-7-18(26)19(8-15)29-5/h6-8,16-17,26H,9-14H2,1-5H3,(H,24,27)