(E)-1-(1-adamantyl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(1-adamantyl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-en-1-one Openeye Name: (E)-1-(1-adamantyl)-3-(4-isopentyloxy-3-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(1-adamantyl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(1-adamantyl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-en-1-one Traditional Name: (E)-1-(1-adamantyl)-3-(4-isoamoxy-3-methoxy-phenyl)prop-2-en-1-one Formula: C25H34O3 MolecularWeight: 382.53566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C=CC(=O)C23CC4CC(C2)CC(C4)C3)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)/C=C/C(=O)C23CC4CC(C2)CC(C4)C3)OC

InChI

InChI=1S/C25H34O3/c1-17(2)8-9-28-22-6-4-18(13-23(22)27-3)5-7-24(26)25-14-19-10-20(15-25)12-21(11-19)16-25/h4-7,13,17,19-21H,8-12,14-16H2,1-3H3/b7-5+