[3-acetamido-4-acetyloxy-1-(4-butylphenyl)-5-methyl-hexan-2-yl] ethanoate

Systemtic Name: [3-acetamido-4-acetyloxy-1-(4-butylphenyl)-5-methyl-hexan-2-yl] ethanoate Openeye Name: [2-acetamido-3-acetoxy-1-[(4-butylphenyl)methyl]-4-methyl-pentyl] acetate CAS Name: acetic acid [3-acetamido-4-acetyloxy-1-(4-butylphenyl)-5-methylhexan-2-yl] ester IUPAC Name: [3-acetamido-4-acetyloxy-1-(4-butylphenyl)-5-methylhexan-2-yl] acetate Traditional Name: acetic acid [2-acetamido-3-acetoxy-1-(4-butylbenzyl)-4-methyl-pentyl] ester Formula: C23H35NO5 MolecularWeight: 405.5277

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(C(C(C(C)C)OC(=O)C)NC(=O)C)OC(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(C(C(C(C)C)OC(=O)C)NC(=O)C)OC(=O)C

InChI

InChI=1S/C23H35NO5/c1-7-8-9-19-10-12-20(13-11-19)14-21(28-17(5)26)22(24-16(4)25)23(15(2)3)29-18(6)27/h10-13,15,21-23H,7-9,14H2,1-6H3,(H,24,25)