ethyl 4-[[2-(2H-chromen-3-yl)-1-(4-ethoxycarbonylphenyl)-4-oxidanylidene-azetidin-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[2-(2H-chromen-3-yl)-1-(4-ethoxycarbonylphenyl)-4-oxidanylidene-azetidin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[2-(2H-chromen-3-yl)-1-(4-ethoxycarbonylphenyl)-4-oxo-azetidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[2-(2H-1-benzopyran-3-yl)-1-(4-ethoxycarbonylphenyl)-4-oxo-2-azetidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2H-chromen-3-yl)-1-(4-ethoxycarbonylphenyl)-4-oxoazetidine-2-carbonyl]amino]benzoate Traditional Name: 4-[[1-(4-carbethoxyphenyl)-2-(2H-chromen-3-yl)-4-keto-azetidine-2-carbonyl]amino]benzoic acid ethyl ester Formula: C31H28N2O7 MolecularWeight: 540.56322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2(CC(=O)N2C3=CC=C(C=C3)C(=O)OCC)C4=CC5=CC=CC=C5OC4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2(CC(=O)N2C3=CC=C(C=C3)C(=O)OCC)C4=CC5=CC=CC=C5OC4

InChI

InChI=1S/C31H28N2O7/c1-3-38-28(35)20-9-13-24(14-10-20)32-30(37)31(23-17-22-7-5-6-8-26(22)40-19-23)18-27(34)33(31)25-15-11-21(12-16-25)29(36)39-4-2/h5-17H,3-4,18-19H2,1-2H3,(H,32,37)