4-[3,3-diethyl-1-[(4-methoxyphenyl)methylcarbamoyl]-4-oxidanylidene-azetidin-2-yl]oxybenzoic acid

Systemtic Name: 4-[3,3-diethyl-1-[(4-methoxyphenyl)methylcarbamoyl]-4-oxidanylidene-azetidin-2-yl]oxybenzoic acid Openeye Name: 4-[3,3-diethyl-1-[(4-methoxyphenyl)methylcarbamoyl]-4-oxo-azetidin-2-yl]oxybenzoic acid CAS Name: 4-[[3,3-diethyl-1-[[(4-methoxyphenyl)methylamino]-oxomethyl]-4-oxo-2-azetidinyl]oxy]benzoic acid IUPAC Name: 4-[3,3-diethyl-1-[(4-methoxyphenyl)methylcarbamoyl]-4-oxoazetidin-2-yl]oxybenzoic acid Traditional Name: 4-[3,3-diethyl-4-keto-1-(p-anisylcarbamoyl)azetidin-2-yl]oxybenzoic acid Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C1=O)C(=O)NCC2=CC=C(C=C2)OC)OC3=CC=C(C=C3)C(=O)O)CC

Isomeric SMILES

CCC1(C(N(C1=O)C(=O)NCC2=CC=C(C=C2)OC)OC3=CC=C(C=C3)C(=O)O)CC

InChI

InChI=1S/C23H26N2O6/c1-4-23(5-2)20(28)25(21(23)31-18-12-8-16(9-13-18)19(26)27)22(29)24-14-15-6-10-17(30-3)11-7-15/h6-13,21H,4-5,14H2,1-3H3,(H,24,29)(H,26,27)