[(3R,4S)-4-(3-ethanoyl-4,6-dimethoxy-2-thiophen-2-yloxy-phenyl)-1-methyl-piperidin-3-yl] ethanoate

Systemtic Name: [(3R,4S)-4-(3-ethanoyl-4,6-dimethoxy-2-thiophen-2-yloxy-phenyl)-1-methyl-piperidin-3-yl] ethanoate Openeye Name: [(3R,4S)-4-[3-acetyl-4,6-dimethoxy-2-(2-thienyloxy)phenyl]-1-methyl-3-piperidyl] acetate CAS Name: acetic acid [(3R,4S)-4-(3-acetyl-4,6-dimethoxy-2-thiophen-2-yloxyphenyl)-1-methyl-3-piperidinyl] ester IUPAC Name: [(3R,4S)-4-(3-acetyl-4,6-dimethoxy-2-thiophen-2-yloxyphenyl)-1-methylpiperidin-3-yl] acetate Traditional Name: acetic acid [(3R,4S)-4-[3-acetyl-4,6-dimethoxy-2-(2-thienyloxy)phenyl]-1-methyl-3-piperidyl] ester Formula: C22H27NO6S MolecularWeight: 433.51788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=C(C=C1OC)OC)C2CCN(CC2OC(=O)C)C)OC3=CC=CS3

Isomeric SMILES

CC(=O)C1=C(C(=C(C=C1OC)OC)[C@@H]2CCN(C[C@@H]2OC(=O)C)C)OC3=CC=CS3

InChI

InChI=1S/C22H27NO6S/c1-13(24)20-16(26-4)11-17(27-5)21(22(20)29-19-7-6-10-30-19)15-8-9-23(3)12-18(15)28-14(2)25/h6-7,10-11,15,18H,8-9,12H2,1-5H3/t15-,18+/m1/s1