3-[(E)-2-(4-hexylphenoxy)-4,4-dimethyl-3-prop-2-enoxy-pent-1-enyl]pyridine

Systemtic Name: 3-[(E)-2-(4-hexylphenoxy)-4,4-dimethyl-3-prop-2-enoxy-pent-1-enyl]pyridine Openeye Name: 3-[(E)-3-allyloxy-2-(4-hexylphenoxy)-4,4-dimethyl-pent-1-enyl]pyridine CAS Name: 3-[(E)-2-(4-hexylphenoxy)-4,4-dimethyl-3-prop-2-enoxypent-1-enyl]pyridine IUPAC Name: 3-[(E)-2-(4-hexylphenoxy)-4,4-dimethyl-3-prop-2-enoxypent-1-enyl]pyridine Traditional Name: 3-[(E)-3-allyloxy-2-(4-hexylphenoxy)-4,4-dimethyl-pent-1-enyl]pyridine Formula: C27H37NO2 MolecularWeight: 407.58818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)OC(=CC2=CN=CC=C2)C(C(C)(C)C)OCC=C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)O/C(=C/C2=CN=CC=C2)/C(C(C)(C)C)OCC=C

InChI

InChI=1S/C27H37NO2/c1-6-8-9-10-12-22-14-16-24(17-15-22)30-25(20-23-13-11-18-28-21-23)26(27(3,4)5)29-19-7-2/h7,11,13-18,20-21,26H,2,6,8-10,12,19H2,1,3-5H3/b25-20+