[4-[(E)-3-[(2S)-2-methylbutoxy]-3-oxidanylidene-prop-1-enyl]phenyl] 4-undecoxybenzoate

Systemtic Name: [4-[(E)-3-[(2S)-2-methylbutoxy]-3-oxidanylidene-prop-1-enyl]phenyl] 4-undecoxybenzoate Openeye Name: [4-[(E)-3-[(2S)-2-methylbutoxy]-3-oxo-prop-1-enyl]phenyl] 4-undecoxybenzoate CAS Name: 4-undecoxybenzoic acid [4-[(E)-3-[(2S)-2-methylbutoxy]-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-[(2S)-2-methylbutoxy]-3-oxoprop-1-enyl]phenyl] 4-undecoxybenzoate Traditional Name: 4-undecoxybenzoic acid [4-[(E)-3-keto-3-[(2S)-2-methylbutoxy]prop-1-enyl]phenyl] ester Formula: C32H44O5 MolecularWeight: 508.68876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=CC(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=C/C(=O)OC[C@@H](C)CC

InChI

InChI=1S/C32H44O5/c1-4-6-7-8-9-10-11-12-13-24-35-29-21-17-28(18-22-29)32(34)37-30-19-14-27(15-20-30)16-23-31(33)36-25-26(3)5-2/h14-23,26H,4-13,24-25H2,1-3H3/b23-16+/t26-/m0/s1