[3-[[4-(4-hexadecoxyphenyl)-5-methyl-1,3-thiazol-2-yl]carbonyl]-4-oxidanyl-naphthalen-1-yl] 2-methylpropyl carbonate

Systemtic Name: [3-[[4-(4-hexadecoxyphenyl)-5-methyl-1,3-thiazol-2-yl]carbonyl]-4-oxidanyl-naphthalen-1-yl] 2-methylpropyl carbonate Openeye Name: [3-[4-(4-hexadecoxyphenyl)-5-methyl-thiazole-2-carbonyl]-4-hydroxy-1-naphthyl] isobutyl carbonate CAS Name: carbonic acid [3-[[4-(4-hexadecoxyphenyl)-5-methyl-2-thiazolyl]-oxomethyl]-4-hydroxy-1-naphthalenyl] 2-methylpropyl ester IUPAC Name: [3-[4-(4-hexadecoxyphenyl)-5-methyl-1,3-thiazole-2-carbonyl]-4-hydroxynaphthalen-1-yl] 2-methylpropyl carbonate Traditional Name: carbonic acid [3-[4-(4-cetyloxyphenyl)-5-methyl-thiazole-2-carbonyl]-4-hydroxy-1-naphthyl] isobutyl ester Formula: C42H55NO6S MolecularWeight: 701.9542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(SC(=N2)C(=O)C3=C(C4=CC=CC=C4C(=C3)OC(=O)OCC(C)C)O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(SC(=N2)C(=O)C3=C(C4=CC=CC=C4C(=C3)OC(=O)OCC(C)C)O)C

InChI

InChI=1S/C42H55NO6S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20-27-47-33-25-23-32(24-26-33)38-31(4)50-41(43-38)40(45)36-28-37(49-42(46)48-29-30(2)3)34-21-18-19-22-35(34)39(36)44/h18-19,21-26,28,30,44H,5-17,20,27,29H2,1-4H3