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

Systemtic Name: [4-[(E)-(nonanoylhydrazinylidene)methyl]phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [4-[(E)-(nonanoylhydrazono)methyl]phenyl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [4-[(E)-(1-oxononylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-(nonanoylhydrazinylidene)methyl]phenyl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [4-[(E)-(pelargonylhydrazono)methyl]phenyl] ester Formula: C25H27ClN2O3S MolecularWeight: 471.01148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27ClN2O3S/c1-2-3-4-5-6-7-12-22(29)28-27-17-18-13-15-19(16-14-18)31-25(30)24-23(26)20-10-8-9-11-21(20)32-24/h8-11,13-17H,2-7,12H2,1H3,(H,28,29)/b27-17+