3-[(2R)-1-azido-2-[3-[(2-methylpropan-2-yl)oxy]propyl]cyclopentyl]propyl 4-methylbenzenesulfonate

Systemtic Name: 3-[(2R)-1-azido-2-[3-[(2-methylpropan-2-yl)oxy]propyl]cyclopentyl]propyl 4-methylbenzenesulfonate Openeye Name: 3-[(2R)-1-azido-2-(3-tert-butoxypropyl)cyclopentyl]propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-[(2R)-1-azido-2-[3-[(2-methylpropan-2-yl)oxy]propyl]cyclopentyl]propyl ester IUPAC Name: 3-[(2R)-1-azido-2-[3-[(2-methylpropan-2-yl)oxy]propyl]cyclopentyl]propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-[(2R)-1-azido-2-(3-tert-butoxypropyl)cyclopentyl]propyl ester Formula: C22H35N3O4S MolecularWeight: 437.596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2(CCCC2CCCOC(C)(C)C)N=[N+]=[N-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2(CCC[C@@H]2CCCOC(C)(C)C)N=[N+]=[N-]

InChI

InChI=1S/C22H35N3O4S/c1-18-10-12-20(13-11-18)30(26,27)29-17-7-15-22(24-25-23)14-5-8-19(22)9-6-16-28-21(2,3)4/h10-13,19H,5-9,14-17H2,1-4H3/t19-,22?/m1/s1