phenacyl 2-[(4-hexylphenyl)carbonylamino]benzoate

Systemtic Name: phenacyl 2-[(4-hexylphenyl)carbonylamino]benzoate Openeye Name: phenacyl 2-[(4-hexylbenzoyl)amino]benzoate CAS Name: 2-[[(4-hexylphenyl)-oxomethyl]amino]benzoic acid phenacyl ester IUPAC Name: phenacyl 2-[(4-hexylbenzoyl)amino]benzoate Traditional Name: 2-[(4-hexylbenzoyl)amino]benzoic acid phenacyl ester Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H29NO4/c1-2-3-4-6-11-21-16-18-23(19-17-21)27(31)29-25-15-10-9-14-24(25)28(32)33-20-26(30)22-12-7-5-8-13-22/h5,7-10,12-19H,2-4,6,11,20H2,1H3,(H,29,31)