(5-nonylpyridin-2-yl) (E)-4-phenyldodec-2-enoate

Systemtic Name: (5-nonylpyridin-2-yl) (E)-4-phenyldodec-2-enoate Openeye Name: (5-nonyl-2-pyridyl) (E)-4-phenyldodec-2-enoate CAS Name: (E)-4-phenyl-2-dodecenoic acid (5-nonyl-2-pyridinyl) ester IUPAC Name: (5-nonylpyridin-2-yl) (E)-4-phenyldodec-2-enoate Traditional Name: (E)-4-phenyldodec-2-enoic acid (5-nonyl-2-pyridyl) ester Formula: C32H47NO2 MolecularWeight: 477.72108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(C=C1)OC(=O)C=CC(CCCCCCCC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCC1=CN=C(C=C1)OC(=O)/C=C/C(CCCCCCCC)C2=CC=CC=C2

InChI

InChI=1S/C32H47NO2/c1-3-5-7-9-11-12-15-19-28-23-25-31(33-27-28)35-32(34)26-24-30(29-20-17-14-18-21-29)22-16-13-10-8-6-4-2/h14,17-18,20-21,23-27,30H,3-13,15-16,19,22H2,1-2H3/b26-24+