[(3R,4S)-4-benzamidothiolan-3-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [(3R,4S)-4-benzamidothiolan-3-yl] 3,4,5-trimethoxybenzoate Openeye Name: [(3R,4S)-4-benzamidotetrahydrothiophen-3-yl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [(3R,4S)-4-benzamido-3-thiolanyl] ester IUPAC Name: [(3R,4S)-4-benzamidothiolan-3-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [(3R,4S)-4-benzamidotetrahydrothiophen-3-yl] ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2CSCC2NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)O[C@H]2CSC[C@H]2NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO6S/c1-25-16-9-14(10-17(26-2)19(16)27-3)21(24)28-18-12-29-11-15(18)22-20(23)13-7-5-4-6-8-13/h4-10,15,18H,11-12H2,1-3H3,(H,22,23)/t15-,18+/m1/s1