[4-[(E)-3-[(2R)-octan-2-yl]oxy-3-oxidanylidene-prop-1-enyl]phenyl] 4-undecoxybenzoate

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

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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)OC(C)CCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C35H50O5/c1-4-6-8-10-11-12-13-14-16-28-38-32-25-21-31(22-26-32)35(37)40-33-23-18-30(19-24-33)20-27-34(36)39-29(3)17-15-9-7-5-2/h18-27,29H,4-17,28H2,1-3H3/b27-20+/t29-/m1/s1