3-decyl-3-(phenylmethyl)tridecan-2-one

Systemtic Name: 3-decyl-3-(phenylmethyl)tridecan-2-one Openeye Name: 3-benzyl-3-decyl-tridecan-2-one CAS Name: 3-decyl-3-(phenylmethyl)-2-tridecanone IUPAC Name: 3-benzyl-3-decyltridecan-2-one Traditional Name: 3-benzyl-3-decyl-tridecan-2-one Formula: C30H52O MolecularWeight: 428.73328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCCCC)(CC1=CC=CC=C1)C(=O)C

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCCCC)(CC1=CC=CC=C1)C(=O)C

InChI

InChI=1S/C30H52O/c1-4-6-8-10-12-14-16-21-25-30(28(3)31,27-29-23-19-18-20-24-29)26-22-17-15-13-11-9-7-5-2/h18-20,23-24H,4-17,21-22,25-27H2,1-3H3