(E,2S,4R)-4-oxidanyl-2-phenylmethoxy-tridec-7-en-6-one

Systemtic Name: (E,2S,4R)-4-oxidanyl-2-phenylmethoxy-tridec-7-en-6-one Openeye Name: (E,2S,4R)-2-benzyloxy-4-hydroxy-tridec-7-en-6-one CAS Name: (E,2S,4R)-4-hydroxy-2-phenylmethoxy-7-tridecen-6-one IUPAC Name: (E,2S,4R)-4-hydroxy-2-phenylmethoxytridec-7-en-6-one Traditional Name: (E,2S,4R)-2-benzoxy-4-hydroxy-tridec-7-en-6-one Formula: C20H30O3 MolecularWeight: 318.4504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC(=O)CC(CC(C)OCC1=CC=CC=C1)O

Isomeric SMILES

CCCCC/C=C/C(=O)C[C@@H](C[C@H](C)OCC1=CC=CC=C1)O

InChI

InChI=1S/C20H30O3/c1-3-4-5-6-10-13-19(21)15-20(22)14-17(2)23-16-18-11-8-7-9-12-18/h7-13,17,20,22H,3-6,14-16H2,1-2H3/b13-10+/t17-,20+/m0/s1