3-hexadecoxy-1-phenylmethoxy-butan-2-ol

Systemtic Name: 3-hexadecoxy-1-phenylmethoxy-butan-2-ol Openeye Name: 1-benzyloxy-3-hexadecoxy-butan-2-ol CAS Name: 3-hexadecoxy-1-phenylmethoxy-2-butanol IUPAC Name: 3-hexadecoxy-1-phenylmethoxybutan-2-ol Traditional Name: 1-benzoxy-3-cetyloxy-butan-2-ol Formula: C27H48O3 MolecularWeight: 420.66822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(C)C(COCC1=CC=CC=C1)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(C)C(COCC1=CC=CC=C1)O

InChI

InChI=1S/C27H48O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-30-25(2)27(28)24-29-23-26-20-17-16-18-21-26/h16-18,20-21,25,27-28H,3-15,19,22-24H2,1-2H3