(1Z)-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-2-ethyl-hexanimidate

Systemtic Name: (1Z)-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-2-ethyl-hexanimidate Openeye Name: (1Z)-N-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-2-ethyl-hexanimidate CAS Name: (1Z)-N-[[[(2,2-dimethyl-3H-benzofuran-7-yl)oxy-oxomethyl]-methylamino]thio]-2-ethylhexanimidate IUPAC Name: (1Z)-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-2-ethylhexanimidate Traditional Name: (1Z)-N-[[(2,2-dimethylcoumaran-7-yl)oxycarbonyl-methyl-amino]thio]-2-ethyl-hexanimidate Formula: C20H29N2O4S- MolecularWeight: 393.52026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=NSN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C)[O-]

Isomeric SMILES

CCCCC(CC)/C(=N/SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C)/[O-]

InChI

InChI=1S/C20H30N2O4S/c1-6-8-10-14(7-2)18(23)21-27-22(5)19(24)25-16-12-9-11-15-13-20(3,4)26-17(15)16/h9,11-12,14H,6-8,10,13H2,1-5H3,(H,21,23)/p-1