methyl 3-[3-[(2-dodecoxy-5-methyl-phenyl)carbamoyl]-4-oxidanyl-naphthalen-1-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[3-[(2-dodecoxy-5-methyl-phenyl)carbamoyl]-4-oxidanyl-naphthalen-1-yl]sulfanylpropanoate Openeye Name: methyl 3-[[3-[(2-dodecoxy-5-methyl-phenyl)carbamoyl]-4-hydroxy-1-naphthyl]sulfanyl]propanoate CAS Name: 3-[[3-[(2-dodecoxy-5-methylanilino)-oxomethyl]-4-hydroxy-1-naphthalenyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[(2-dodecoxy-5-methylphenyl)carbamoyl]-4-hydroxynaphthalen-1-yl]sulfanylpropanoate Traditional Name: 3-[[4-hydroxy-3-[(2-lauryloxy-5-methyl-phenyl)carbamoyl]-1-naphthyl]thio]propionic acid methyl ester Formula: C34H45NO5S MolecularWeight: 579.7898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)C)NC(=O)C2=C(C3=CC=CC=C3C(=C2)SCCC(=O)OC)O

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)C)NC(=O)C2=C(C3=CC=CC=C3C(=C2)SCCC(=O)OC)O

InChI

InChI=1S/C34H45NO5S/c1-4-5-6-7-8-9-10-11-12-15-21-40-30-19-18-25(2)23-29(30)35-34(38)28-24-31(41-22-20-32(36)39-3)26-16-13-14-17-27(26)33(28)37/h13-14,16-19,23-24,37H,4-12,15,20-22H2,1-3H3,(H,35,38)