2-[1,2-benzoxazol-3-ylcarbonyl(propan-2-yl)amino]ethyl methanesulfonate

Systemtic Name: 2-[1,2-benzoxazol-3-ylcarbonyl(propan-2-yl)amino]ethyl methanesulfonate Openeye Name: 2-[1,2-benzoxazole-3-carbonyl(isopropyl)amino]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[[1,2-benzoxazol-3-yl(oxo)methyl]-propan-2-ylamino]ethyl ester IUPAC Name: 2-[1,2-benzoxazole-3-carbonyl(propan-2-yl)amino]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[indoxazene-3-carbonyl(isopropyl)amino]ethyl ester Formula: C14H18N2O5S MolecularWeight: 326.36812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCOS(=O)(=O)C)C(=O)C1=NOC2=CC=CC=C21

Isomeric SMILES

CC(C)N(CCOS(=O)(=O)C)C(=O)C1=NOC2=CC=CC=C21

InChI

InChI=1S/C14H18N2O5S/c1-10(2)16(8-9-20-22(3,18)19)14(17)13-11-6-4-5-7-12(11)21-15-13/h4-7,10H,8-9H2,1-3H3