[4-(2-acetyloxyethyl)-4-(methoxycarbonylamino)-6-(4-octylphenyl)hexyl] ethanoate

Systemtic Name: [4-(2-acetyloxyethyl)-4-(methoxycarbonylamino)-6-(4-octylphenyl)hexyl] ethanoate Openeye Name: [4-(2-acetoxyethyl)-4-(methoxycarbonylamino)-6-(4-octylphenyl)hexyl] acetate CAS Name: acetic acid [4-(2-acetyloxyethyl)-4-(methoxycarbonylamino)-6-(4-octylphenyl)hexyl] ester IUPAC Name: [4-(2-acetyloxyethyl)-4-(methoxycarbonylamino)-6-(4-octylphenyl)hexyl] acetate Traditional Name: acetic acid [4-(2-acetoxyethyl)-4-(carbomethoxyamino)-6-(4-octylphenyl)hexyl] ester Formula: C28H45NO6 MolecularWeight: 491.66

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(CCCOC(=O)C)(CCOC(=O)C)NC(=O)OC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(CCCOC(=O)C)(CCOC(=O)C)NC(=O)OC

InChI

InChI=1S/C28H45NO6/c1-5-6-7-8-9-10-12-25-13-15-26(16-14-25)17-19-28(29-27(32)33-4,20-22-35-24(3)31)18-11-21-34-23(2)30/h13-16H,5-12,17-22H2,1-4H3,(H,29,32)