[(Z,2R)-1-(anthracen-9-ylmethoxy)-1-oxidanylidene-octadec-9-en-2-yl] naphthalene-2-carboxylate

Systemtic Name: [(Z,2R)-1-(anthracen-9-ylmethoxy)-1-oxidanylidene-octadec-9-en-2-yl] naphthalene-2-carboxylate Openeye Name: [(Z,1R)-1-(9-anthrylmethoxycarbonyl)heptadec-8-enyl] naphthalene-2-carboxylate CAS Name: 2-naphthalenecarboxylic acid [(Z,2R)-1-(9-anthracenylmethoxy)-1-oxooctadec-9-en-2-yl] ester IUPAC Name: [(Z,2R)-1-(anthracen-9-ylmethoxy)-1-oxooctadec-9-en-2-yl] naphthalene-2-carboxylate Traditional Name: naphthalene-2-carboxylic acid [(Z,1R)-1-(9-anthrylmethoxycarbonyl)heptadec-8-enyl] ester Formula: C44H50O4 MolecularWeight: 642.8654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(C(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31)OC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CCCCCCCC/C=C\CCCCCC[C@H](C(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31)OC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C44H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-28-42(48-43(45)38-30-29-34-22-16-17-23-35(34)31-38)44(46)47-33-41-39-26-20-18-24-36(39)32-37-25-19-21-27-40(37)41/h9-10,16-27,29-32,42H,2-8,11-15,28,33H2,1H3/b10-9-/t42-/m1/s1