[(E)-2-(hexanoylamino)undec-4-en-3-yl] benzoate

Systemtic Name: [(E)-2-(hexanoylamino)undec-4-en-3-yl] benzoate Openeye Name: [(E)-1-[1-(hexanoylamino)ethyl]non-2-enyl] benzoate CAS Name: benzoic acid [(E)-2-(1-oxohexylamino)undec-4-en-3-yl] ester IUPAC Name: [(E)-2-(hexanoylamino)undec-4-en-3-yl] benzoate Traditional Name: benzoic acid [(E)-1-[1-(caproylamino)ethyl]non-2-enyl] ester Formula: C24H37NO3 MolecularWeight: 387.55548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC(C(C)NC(=O)CCCCC)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCC/C=C/C(C(C)NC(=O)CCCCC)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C24H37NO3/c1-4-6-8-9-10-15-18-22(20(3)25-23(26)19-12-7-5-2)28-24(27)21-16-13-11-14-17-21/h11,13-18,20,22H,4-10,12,19H2,1-3H3,(H,25,26)/b18-15+