[4-[4-[[4-(3-oxidanyl-1-adamantyl)phenyl]iminomethyl]phenyl]phenyl] ethanoate

Systemtic Name: [4-[4-[[4-(3-oxidanyl-1-adamantyl)phenyl]iminomethyl]phenyl]phenyl] ethanoate Openeye Name: [4-[4-[[4-(3-hydroxy-1-adamantyl)phenyl]iminomethyl]phenyl]phenyl] acetate CAS Name: acetic acid [4-[4-[[4-(3-hydroxy-1-adamantyl)phenyl]iminomethyl]phenyl]phenyl] ester IUPAC Name: [4-[4-[[4-(3-hydroxy-1-adamantyl)phenyl]iminomethyl]phenyl]phenyl] acetate Traditional Name: acetic acid [4-[4-[[4-(3-hydroxy-1-adamantyl)phenyl]iminomethyl]phenyl]phenyl] ester Formula: C31H31NO3 MolecularWeight: 465.58274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C=NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)(C5)O

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C=NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)(C5)O

InChI

InChI=1S/C31H31NO3/c1-21(33)35-29-12-6-26(7-13-29)25-4-2-22(3-5-25)19-32-28-10-8-27(9-11-28)30-15-23-14-24(16-30)18-31(34,17-23)20-30/h2-13,19,23-24,34H,14-18,20H2,1H3