methyl 1-[4-(3-methylbutoxy)phenyl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[4-(3-methylbutoxy)phenyl]carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(4-isopentyloxybenzoyl)pyrrolidine-2-carboxylate CAS Name: 1-[[4-(3-methylbutoxy)phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(3-methylbutoxy)benzoyl]pyrrolidine-2-carboxylate Traditional Name: 1-(4-isoamoxybenzoyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)OC

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)OC

InChI

InChI=1S/C18H25NO4/c1-13(2)10-12-23-15-8-6-14(7-9-15)17(20)19-11-4-5-16(19)18(21)22-3/h6-9,13,16H,4-5,10-12H2,1-3H3