methyl 4-[1-(4-ethoxycarbonylphenyl)-3-(2-methylphenoxy)-4-oxidanylidene-azetidin-2-yl]benzoate

Systemtic Name: methyl 4-[1-(4-ethoxycarbonylphenyl)-3-(2-methylphenoxy)-4-oxidanylidene-azetidin-2-yl]benzoate Openeye Name: methyl 4-[1-(4-ethoxycarbonylphenyl)-3-(2-methylphenoxy)-4-oxo-azetidin-2-yl]benzoate CAS Name: 4-[1-(4-ethoxycarbonylphenyl)-3-(2-methylphenoxy)-4-oxo-2-azetidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-(4-ethoxycarbonylphenyl)-3-(2-methylphenoxy)-4-oxoazetidin-2-yl]benzoate Traditional Name: 4-[1-(4-carbethoxyphenyl)-4-keto-3-(2-methylphenoxy)azetidin-2-yl]benzoic acid methyl ester Formula: C27H25NO6 MolecularWeight: 459.4905

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(C(C2=O)OC3=CC=CC=C3C)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(C(C2=O)OC3=CC=CC=C3C)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C27H25NO6/c1-4-33-27(31)20-13-15-21(16-14-20)28-23(18-9-11-19(12-10-18)26(30)32-3)24(25(28)29)34-22-8-6-5-7-17(22)2/h5-16,23-24H,4H2,1-3H3