[(4S,5S)-7-acetyloxy-5-(hydroxymethyl)-4-[(4-methoxyphenyl)amino]heptyl] ethanoate

Systemtic Name: [(4S,5S)-7-acetyloxy-5-(hydroxymethyl)-4-[(4-methoxyphenyl)amino]heptyl] ethanoate Openeye Name: [(4S,5S)-7-acetoxy-5-(hydroxymethyl)-4-(4-methoxyanilino)heptyl] acetate CAS Name: acetic acid [(4S,5S)-7-acetyloxy-5-(hydroxymethyl)-4-(4-methoxyanilino)heptyl] ester IUPAC Name: [(4S,5S)-7-acetyloxy-5-(hydroxymethyl)-4-(4-methoxyanilino)heptyl] acetate Traditional Name: acetic acid [(4S,5S)-7-acetoxy-5-methylol-4-(p-anisidino)heptyl] ester Formula: C19H29NO6 MolecularWeight: 367.43666

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCC(C(CCOC(=O)C)CO)NC1=CC=C(C=C1)OC

Isomeric SMILES

CC(=O)OCCC[C@@H]([C@H](CCOC(=O)C)CO)NC1=CC=C(C=C1)OC

InChI

InChI=1S/C19H29NO6/c1-14(22)25-11-4-5-19(16(13-21)10-12-26-15(2)23)20-17-6-8-18(24-3)9-7-17/h6-9,16,19-21H,4-5,10-13H2,1-3H3/t16-,19+/m1/s1