tert-butyl N-(3,4-dihydro-2H-1,5-benzoxathiepin-3-yl)carbamate

Systemtic Name: tert-butyl N-(3,4-dihydro-2H-1,5-benzoxathiepin-3-yl)carbamate Openeye Name: tert-butyl N-(3,4-dihydro-2H-1,5-benzoxathiepin-3-yl)carbamate CAS Name: N-(3,4-dihydro-2H-1,5-benzoxathiepin-3-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3,4-dihydro-2H-1,5-benzoxathiepin-3-yl)carbamate Traditional Name: N-(3,4-dihydro-2H-1,5-benzoxathiepin-3-yl)carbamic acid tert-butyl ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1COC2=CC=CC=C2SC1

Isomeric SMILES

CC(C)(C)OC(=O)NC1COC2=CC=CC=C2SC1

InChI

InChI=1S/C14H19NO3S/c1-14(2,3)18-13(16)15-10-8-17-11-6-4-5-7-12(11)19-9-10/h4-7,10H,8-9H2,1-3H3,(H,15,16)