ethyl (E)-3-[3-[5-(1-adamantyl)-4-methoxy-2-methyl-phenyl]-4-oxidanyl-phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-[5-(1-adamantyl)-4-methoxy-2-methyl-phenyl]-4-oxidanyl-phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[3-[5-(1-adamantyl)-4-methoxy-2-methyl-phenyl]-4-hydroxy-phenyl]prop-2-enoate CAS Name: (E)-3-[3-[5-(1-adamantyl)-4-methoxy-2-methylphenyl]-4-hydroxyphenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[5-(1-adamantyl)-4-methoxy-2-methylphenyl]-4-hydroxyphenyl]prop-2-enoate Traditional Name: (E)-3-[3-[5-(1-adamantyl)-4-methoxy-2-methyl-phenyl]-4-hydroxy-phenyl]acrylic acid ethyl ester Formula: C29H34O4 MolecularWeight: 446.57786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC(=C(C=C1)O)C2=CC(=C(C=C2C)OC)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)/C=C/C1=CC(=C(C=C1)O)C2=CC(=C(C=C2C)OC)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C29H34O4/c1-4-33-28(31)8-6-19-5-7-26(30)24(13-19)23-14-25(27(32-3)9-18(23)2)29-15-20-10-21(16-29)12-22(11-20)17-29/h5-9,13-14,20-22,30H,4,10-12,15-17H2,1-3H3/b8-6+