[2-acetamido-3-(2-methylpropyl)-6-[2-(oxidanylamino)-2-oxidanylidene-ethyl]azulen-1-yl] ethyl carbonate

Systemtic Name: [2-acetamido-3-(2-methylpropyl)-6-[2-(oxidanylamino)-2-oxidanylidene-ethyl]azulen-1-yl] ethyl carbonate Openeye Name: [2-acetamido-6-[2-(hydroxyamino)-2-oxo-ethyl]-3-isobutyl-azulen-1-yl] ethyl carbonate CAS Name: carbonic acid [2-acetamido-6-[2-(hydroxyamino)-2-oxoethyl]-3-(2-methylpropyl)-1-azulenyl] ethyl ester IUPAC Name: [2-acetamido-6-[2-(hydroxyamino)-2-oxoethyl]-3-(2-methylpropyl)azulen-1-yl] ethyl carbonate Traditional Name: carbonic acid [2-acetamido-6-[2-(hydroxyamino)-2-keto-ethyl]-3-isobutyl-azulen-1-yl] ethyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1=C(C(=C2C1=CC=C(C=C2)CC(=O)NO)CC(C)C)NC(=O)C

Isomeric SMILES

CCOC(=O)OC1=C(C(=C2C1=CC=C(C=C2)CC(=O)NO)CC(C)C)NC(=O)C

InChI

InChI=1S/C21H26N2O6/c1-5-28-21(26)29-20-16-9-7-14(11-18(25)23-27)6-8-15(16)17(10-12(2)3)19(20)22-13(4)24/h6-9,12,27H,5,10-11H2,1-4H3,(H,22,24)(H,23,25)