4-[3,3-diethyl-1-[methyl(1-phenylbutyl)carbamoyl]-4-oxidanylidene-azetidin-2-yl]oxybenzoic acid

Systemtic Name: 4-[3,3-diethyl-1-[methyl(1-phenylbutyl)carbamoyl]-4-oxidanylidene-azetidin-2-yl]oxybenzoic acid Openeye Name: 4-[3,3-diethyl-1-[methyl(1-phenylbutyl)carbamoyl]-4-oxo-azetidin-2-yl]oxybenzoic acid CAS Name: 4-[[3,3-diethyl-1-[[methyl(1-phenylbutyl)amino]-oxomethyl]-4-oxo-2-azetidinyl]oxy]benzoic acid IUPAC Name: 4-[3,3-diethyl-1-[methyl(1-phenylbutyl)carbamoyl]-4-oxoazetidin-2-yl]oxybenzoic acid Traditional Name: 4-[3,3-diethyl-4-keto-1-[methyl(1-phenylbutyl)carbamoyl]azetidin-2-yl]oxybenzoic acid Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)N(C)C(=O)N2C(C(C2=O)(CC)CC)OC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCC(C1=CC=CC=C1)N(C)C(=O)N2C(C(C2=O)(CC)CC)OC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C26H32N2O5/c1-5-11-21(18-12-9-8-10-13-18)27(4)25(32)28-23(31)26(6-2,7-3)24(28)33-20-16-14-19(15-17-20)22(29)30/h8-10,12-17,21,24H,5-7,11H2,1-4H3,(H,29,30)