methyl 7-octadecoxy-4-oxidanyl-1,4,4a,8a-tetrahydronaphthalene-2-carboxylate

Systemtic Name: methyl 7-octadecoxy-4-oxidanyl-1,4,4a,8a-tetrahydronaphthalene-2-carboxylate Openeye Name: methyl 4-hydroxy-7-octadecoxy-1,4,4a,8a-tetrahydronaphthalene-2-carboxylate CAS Name: 4-hydroxy-7-octadecoxy-1,4,4a,8a-tetrahydronaphthalene-2-carboxylic acid methyl ester IUPAC Name: methyl 4-hydroxy-7-octadecoxy-1,4,4a,8a-tetrahydronaphthalene-2-carboxylate Traditional Name: 4-hydroxy-7-stearyloxy-1,4,4a,8a-tetrahydronaphthalene-2-carboxylic acid methyl ester Formula: C30H50O4 MolecularWeight: 474.7156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC2CC(=CC(C2C=C1)O)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC2CC(=CC(C2C=C1)O)C(=O)OC

InChI

InChI=1S/C30H50O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-34-27-19-20-28-25(23-27)22-26(24-29(28)31)30(32)33-2/h19-20,23-25,28-29,31H,3-18,21-22H2,1-2H3