methyl 4-[1-(4-methoxyphenyl)-4-oxidanylidene-3-(3-phenylpropyl)azetidin-2-yl]benzoate

Systemtic Name: methyl 4-[1-(4-methoxyphenyl)-4-oxidanylidene-3-(3-phenylpropyl)azetidin-2-yl]benzoate Openeye Name: methyl 4-[1-(4-methoxyphenyl)-4-oxo-3-(3-phenylpropyl)azetidin-2-yl]benzoate CAS Name: 4-[1-(4-methoxyphenyl)-4-oxo-3-(3-phenylpropyl)-2-azetidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-(4-methoxyphenyl)-4-oxo-3-(3-phenylpropyl)azetidin-2-yl]benzoate Traditional Name: 4-[4-keto-1-(4-methoxyphenyl)-3-(3-phenylpropyl)azetidin-2-yl]benzoic acid methyl ester Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(C2=O)CCCC3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C(C2=O)CCCC3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C27H27NO4/c1-31-23-17-15-22(16-18-23)28-25(20-11-13-21(14-12-20)27(30)32-2)24(26(28)29)10-6-9-19-7-4-3-5-8-19/h3-5,7-8,11-18,24-25H,6,9-10H2,1-2H3