[4-[(Z)-2-methyl-3-[(2R)-octan-2-yl]oxy-3-oxidanylidene-prop-1-enyl]phenyl] 4-decoxybenzoate

Systemtic Name: [4-[(Z)-2-methyl-3-[(2R)-octan-2-yl]oxy-3-oxidanylidene-prop-1-enyl]phenyl] 4-decoxybenzoate Openeye Name: [4-[(Z)-2-methyl-3-[(1R)-1-methylheptoxy]-3-oxo-prop-1-enyl]phenyl] 4-decoxybenzoate CAS Name: 4-decoxybenzoic acid [4-[(Z)-2-methyl-3-[(2R)-octan-2-yl]oxy-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(Z)-2-methyl-3-[(2R)-octan-2-yl]oxy-3-oxoprop-1-enyl]phenyl] 4-decoxybenzoate Traditional Name: 4-decoxybenzoic acid [4-[(Z)-3-keto-2-methyl-3-[(1R)-1-methylheptoxy]prop-1-enyl]phenyl] ester Formula: C35H50O5 MolecularWeight: 550.7685

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C)C(=O)OC(C)CCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=C(/C)\C(=O)O[C@H](C)CCCCCC

InChI

InChI=1S/C35H50O5/c1-5-7-9-11-12-13-14-16-26-38-32-24-20-31(21-25-32)35(37)40-33-22-18-30(19-23-33)27-28(3)34(36)39-29(4)17-15-10-8-6-2/h18-25,27,29H,5-17,26H2,1-4H3/b28-27-/t29-/m1/s1