methyl 3-[3-[3-oxidanylidene-2-phenyl-4-(3-phenylpropyl)azetidin-2-yl]phenyl]propanoate

Systemtic Name: methyl 3-[3-[3-oxidanylidene-2-phenyl-4-(3-phenylpropyl)azetidin-2-yl]phenyl]propanoate Openeye Name: methyl 3-[3-[3-oxo-2-phenyl-4-(3-phenylpropyl)azetidin-2-yl]phenyl]propanoate CAS Name: 3-[3-[3-oxo-2-phenyl-4-(3-phenylpropyl)-2-azetidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[3-oxo-2-phenyl-4-(3-phenylpropyl)azetidin-2-yl]phenyl]propanoate Traditional Name: 3-[3-[3-keto-2-phenyl-4-(3-phenylpropyl)azetidin-2-yl]phenyl]propionic acid methyl ester Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=CC(=C1)C2(C(=O)C(N2)CCCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCC1=CC=CC(=C1)C2(C(=O)C(N2)CCCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H29NO3/c1-32-26(30)19-18-22-13-8-16-24(20-22)28(23-14-6-3-7-15-23)27(31)25(29-28)17-9-12-21-10-4-2-5-11-21/h2-8,10-11,13-16,20,25,29H,9,12,17-19H2,1H3