[3-[(2,2-dimethyl-6-methylsulfonyloxy-1,3-dioxepan-5-yl)carbamoyl]-2-methyl-phenyl] ethanoate

Systemtic Name: [3-[(2,2-dimethyl-6-methylsulfonyloxy-1,3-dioxepan-5-yl)carbamoyl]-2-methyl-phenyl] ethanoate Openeye Name: [3-[(2,2-dimethyl-6-methylsulfonyloxy-1,3-dioxepan-5-yl)carbamoyl]-2-methyl-phenyl] acetate CAS Name: acetic acid [3-[[(2,2-dimethyl-6-methylsulfonyloxy-1,3-dioxepan-5-yl)amino]-oxomethyl]-2-methylphenyl] ester IUPAC Name: [3-[(2,2-dimethyl-6-methylsulfonyloxy-1,3-dioxepan-5-yl)carbamoyl]-2-methylphenyl] acetate Traditional Name: acetic acid [3-[(2,2-dimethyl-6-methylsulfonyloxy-1,3-dioxepan-5-yl)carbamoyl]-2-methyl-phenyl] ester Formula: C18H25NO8S MolecularWeight: 415.458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1OC(=O)C)C(=O)NC2COC(OCC2OS(=O)(=O)C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1OC(=O)C)C(=O)NC2COC(OCC2OS(=O)(=O)C)(C)C

InChI

InChI=1S/C18H25NO8S/c1-11-13(7-6-8-15(11)26-12(2)20)17(21)19-14-9-24-18(3,4)25-10-16(14)27-28(5,22)23/h6-8,14,16H,9-10H2,1-5H3,(H,19,21)