[4-[(Z)-2-methyl-3-[(2S)-2-methylbutoxy]-3-oxidanylidene-prop-1-enyl]phenyl] 4-nonoxybenzoate

Systemtic Name: [4-[(Z)-2-methyl-3-[(2S)-2-methylbutoxy]-3-oxidanylidene-prop-1-enyl]phenyl] 4-nonoxybenzoate Openeye Name: [4-[(Z)-2-methyl-3-[(2S)-2-methylbutoxy]-3-oxo-prop-1-enyl]phenyl] 4-nonoxybenzoate CAS Name: 4-nonoxybenzoic acid [4-[(Z)-2-methyl-3-[(2S)-2-methylbutoxy]-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(Z)-2-methyl-3-[(2S)-2-methylbutoxy]-3-oxoprop-1-enyl]phenyl] 4-nonoxybenzoate Traditional Name: 4-nonoxybenzoic acid [4-[(Z)-3-keto-2-methyl-3-[(2S)-2-methylbutoxy]prop-1-enyl]phenyl] ester Formula: C31H42O5 MolecularWeight: 494.66218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C)C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=C(/C)\C(=O)OC[C@@H](C)CC

InChI

InChI=1S/C31H42O5/c1-5-7-8-9-10-11-12-21-34-28-19-15-27(16-20-28)31(33)36-29-17-13-26(14-18-29)22-25(4)30(32)35-23-24(3)6-2/h13-20,22,24H,5-12,21,23H2,1-4H3/b25-22-/t24-/m0/s1