2,3-dihydro-1,4-benzodioxin-3-ylmethyl N-[butyl(methylsulfonyl)carbamoyl]carbamate

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl N-[butyl(methylsulfonyl)carbamoyl]carbamate Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl N-[butyl(methylsulfonyl)carbamoyl]carbamate CAS Name: N-[[butyl(methylsulfonyl)amino]-oxomethyl]carbamic acid 2,3-dihydro-1,4-benzodioxin-3-ylmethyl ester IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl N-[butyl(methylsulfonyl)carbamoyl]carbamate Traditional Name: N-[butyl(mesyl)carbamoyl]carbamic acid 2,3-dihydro-1,4-benzodioxin-3-ylmethyl ester Formula: C16H22N2O7S MolecularWeight: 386.42008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)NC(=O)OCC1COC2=CC=CC=C2O1)S(=O)(=O)C

Isomeric SMILES

CCCCN(C(=O)NC(=O)OCC1COC2=CC=CC=C2O1)S(=O)(=O)C

InChI

InChI=1S/C16H22N2O7S/c1-3-4-9-18(26(2,21)22)15(19)17-16(20)24-11-12-10-23-13-7-5-6-8-14(13)25-12/h5-8,12H,3-4,9-11H2,1-2H3,(H,17,19,20)