(2-cyclopentylphenyl) 3-[(3-methoxy-4-oxidanyl-phenyl)methylcarbamoyl]azetidine-1-carboxylate

Systemtic Name: (2-cyclopentylphenyl) 3-[(3-methoxy-4-oxidanyl-phenyl)methylcarbamoyl]azetidine-1-carboxylate Openeye Name: (2-cyclopentylphenyl) 3-[(4-hydroxy-3-methoxy-phenyl)methylcarbamoyl]azetidine-1-carboxylate CAS Name: 3-[[(4-hydroxy-3-methoxyphenyl)methylamino]-oxomethyl]-1-azetidinecarboxylic acid (2-cyclopentylphenyl) ester IUPAC Name: (2-cyclopentylphenyl) 3-[(4-hydroxy-3-methoxyphenyl)methylcarbamoyl]azetidine-1-carboxylate Traditional Name: 3-(vanillylcarbamoyl)azetidine-1-carboxylic acid (2-cyclopentylphenyl) ester Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)C2CN(C2)C(=O)OC3=CC=CC=C3C4CCCC4)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)C2CN(C2)C(=O)OC3=CC=CC=C3C4CCCC4)O

InChI

InChI=1S/C24H28N2O5/c1-30-22-12-16(10-11-20(22)27)13-25-23(28)18-14-26(15-18)24(29)31-21-9-5-4-8-19(21)17-6-2-3-7-17/h4-5,8-12,17-18,27H,2-3,6-7,13-15H2,1H3,(H,25,28)