(5-nonylpyrimidin-2-yl) (E)-4-phenylundec-2-enoate

Systemtic Name: (5-nonylpyrimidin-2-yl) (E)-4-phenylundec-2-enoate Openeye Name: (5-nonylpyrimidin-2-yl) (E)-4-phenylundec-2-enoate CAS Name: (E)-4-phenyl-2-undecenoic acid (5-nonyl-2-pyrimidinyl) ester IUPAC Name: (5-nonylpyrimidin-2-yl) (E)-4-phenylundec-2-enoate Traditional Name: (E)-4-phenylundec-2-enoic acid (5-nonylpyrimidin-2-yl) ester Formula: C30H44N2O2 MolecularWeight: 464.68256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)OC(=O)C=CC(CCCCCCC)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C30H44N2O2/c1-3-5-7-9-10-12-14-18-26-24-31-30(32-25-26)34-29(33)23-22-28(21-15-11-8-6-4-2)27-19-16-13-17-20-27/h13,16-17,19-20,22-25,28H,3-12,14-15,18,21H2,1-2H3/b23-22+