[(E)-2,4-bis(oxidanylidene)pentylideneamino] phenylmethanesulfonate

Systemtic Name: [(E)-2,4-bis(oxidanylidene)pentylideneamino] phenylmethanesulfonate Openeye Name: [(E)-2,4-dioxopentylideneamino] phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid [(E)-2,4-dioxopentylideneamino] ester IUPAC Name: [(E)-2,4-dioxopentylideneamino] phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid [(E)-2,4-diketopentylideneamino] ester Formula: C12H13NO5S MolecularWeight: 283.30032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C=NOS(=O)(=O)CC1=CC=CC=C1

Isomeric SMILES

CC(=O)CC(=O)/C=N/OS(=O)(=O)CC1=CC=CC=C1

InChI

InChI=1S/C12H13NO5S/c1-10(14)7-12(15)8-13-18-19(16,17)9-11-5-3-2-4-6-11/h2-6,8H,7,9H2,1H3/b13-8+