tert-butyl 4-[4-[(2-ethoxy-2-oxidanylidene-ethyl)sulfonylamino]-3-methyl-phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(2-ethoxy-2-oxidanylidene-ethyl)sulfonylamino]-3-methyl-phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(2-ethoxy-2-oxo-ethyl)sulfonylamino]-3-methyl-phenoxy]piperidine-1-carboxylate CAS Name: 4-[4-[(2-ethoxy-2-oxoethyl)sulfonylamino]-3-methylphenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(2-ethoxy-2-oxoethyl)sulfonylamino]-3-methylphenoxy]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-ethoxy-2-keto-ethyl)sulfonylamino]-3-methyl-phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H32N2O7S MolecularWeight: 456.55298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)NC1=C(C=C(C=C1)OC2CCN(CC2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)CS(=O)(=O)NC1=C(C=C(C=C1)OC2CCN(CC2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C21H32N2O7S/c1-6-28-19(24)14-31(26,27)22-18-8-7-17(13-15(18)2)29-16-9-11-23(12-10-16)20(25)30-21(3,4)5/h7-8,13,16,22H,6,9-12,14H2,1-5H3