[2-acetamido-3-methoxycarbonyloxy-6-(sulfanylmethyl)azulen-1-yl] methyl carbonate

Systemtic Name: [2-acetamido-3-methoxycarbonyloxy-6-(sulfanylmethyl)azulen-1-yl] methyl carbonate Openeye Name: [2-acetamido-3-methoxycarbonyloxy-6-(sulfanylmethyl)azulen-1-yl] methyl carbonate CAS Name: carbonic acid [2-acetamido-6-(mercaptomethyl)-3-methoxycarbonyloxy-1-azulenyl] methyl ester IUPAC Name: [2-acetamido-3-methoxycarbonyloxy-6-(sulfanylmethyl)azulen-1-yl] methyl carbonate Traditional Name: carbonic acid [2-acetamido-3-carbomethoxyoxy-6-(mercaptomethyl)azulen-1-yl] methyl ester Formula: C17H17NO7S MolecularWeight: 379.38438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=CC=C(C=CC2=C1OC(=O)OC)CS)OC(=O)OC

Isomeric SMILES

CC(=O)NC1=C(C2=CC=C(C=CC2=C1OC(=O)OC)CS)OC(=O)OC

InChI

InChI=1S/C17H17NO7S/c1-9(19)18-13-14(24-16(20)22-2)11-6-4-10(8-26)5-7-12(11)15(13)25-17(21)23-3/h4-7,26H,8H2,1-3H3,(H,18,19)