(4-tert-butylcyclohexyl) 3-[(3-methoxy-4-oxidanyl-phenyl)methylcarbamoyl]azetidine-1-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OC(=O)N2CC(C2)C(=O)NCC3=CC(=C(C=C3)O)OC

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OC(=O)N2CC(C2)C(=O)NCC3=CC(=C(C=C3)O)OC

InChI

InChI=1S/C23H34N2O5/c1-23(2,3)17-6-8-18(9-7-17)30-22(28)25-13-16(14-25)21(27)24-12-15-5-10-19(26)20(11-15)29-4/h5,10-11,16-18,26H,6-9,12-14H2,1-4H3,(H,24,27)