[3-(acetyloxymethyl)-5-(4-decylphenyl)-3-(methoxycarbonylamino)pentyl] ethanoate

Systemtic Name: [3-(acetyloxymethyl)-5-(4-decylphenyl)-3-(methoxycarbonylamino)pentyl] ethanoate Openeye Name: [3-(acetoxymethyl)-5-(4-decylphenyl)-3-(methoxycarbonylamino)pentyl] acetate CAS Name: acetic acid [3-(acetyloxymethyl)-5-(4-decylphenyl)-3-(methoxycarbonylamino)pentyl] ester IUPAC Name: [3-(acetyloxymethyl)-5-(4-decylphenyl)-3-(methoxycarbonylamino)pentyl] acetate Traditional Name: acetic acid [3-(acetoxymethyl)-3-(carbomethoxyamino)-5-(4-decylphenyl)pentyl] ester Formula: C28H45NO6 MolecularWeight: 491.66

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)CCC(CCOC(=O)C)(COC(=O)C)NC(=O)OC

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)CCC(CCOC(=O)C)(COC(=O)C)NC(=O)OC

InChI

InChI=1S/C28H45NO6/c1-5-6-7-8-9-10-11-12-13-25-14-16-26(17-15-25)18-19-28(22-35-24(3)31,29-27(32)33-4)20-21-34-23(2)30/h14-17H,5-13,18-22H2,1-4H3,(H,29,32)