[4-[(E)-[2-(decanoylamino)ethanoylhydrazinylidene]methyl]phenyl] 2-methylbenzoate

Systemtic Name: [4-[(E)-[2-(decanoylamino)ethanoylhydrazinylidene]methyl]phenyl] 2-methylbenzoate Openeye Name: [4-[(E)-[[2-(decanoylamino)acetyl]hydrazono]methyl]phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [4-[(E)-[[1-oxo-2-(1-oxodecylamino)ethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[[2-(decanoylamino)acetyl]hydrazinylidene]methyl]phenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [4-[(E)-[[2-(caprylamino)acetyl]hydrazono]methyl]phenyl] ester Formula: C27H35N3O4 MolecularWeight: 465.5845

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NCC(=O)NN=CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2C

Isomeric SMILES

CCCCCCCCCC(=O)NCC(=O)N/N=C/C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C27H35N3O4/c1-3-4-5-6-7-8-9-14-25(31)28-20-26(32)30-29-19-22-15-17-23(18-16-22)34-27(33)24-13-11-10-12-21(24)2/h10-13,15-19H,3-9,14,20H2,1-2H3,(H,28,31)(H,30,32)/b29-19+