[4-[(E)-(dodecanoylhydrazinylidene)methyl]phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [4-[(E)-(dodecanoylhydrazinylidene)methyl]phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [4-[(E)-(dodecanoylhydrazono)methyl]phenyl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [4-[(E)-(1-oxododecylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-(dodecanoylhydrazinylidene)methyl]phenyl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [4-[(E)-(lauroylhydrazono)methyl]phenyl] ester Formula: C28H33ClN2O3S MolecularWeight: 513.09122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NN=CC1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CCCCCCCCCCCC(=O)N/N=C/C1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C28H33ClN2O3S/c1-2-3-4-5-6-7-8-9-10-15-25(32)31-30-20-21-16-18-22(19-17-21)34-28(33)27-26(29)23-13-11-12-14-24(23)35-27/h11-14,16-20H,2-10,15H2,1H3,(H,31,32)/b30-20+