phenyl 2-ethoxy-4-(1-formamido-3-oxidanylidene-propyl)-3-oxidanyl-benzenesulfonate

Systemtic Name: phenyl 2-ethoxy-4-(1-formamido-3-oxidanylidene-propyl)-3-oxidanyl-benzenesulfonate Openeye Name: phenyl 2-ethoxy-4-(1-formamido-3-oxo-propyl)-3-hydroxy-benzenesulfonate CAS Name: 2-ethoxy-4-(1-formamido-3-oxopropyl)-3-hydroxybenzenesulfonic acid phenyl ester IUPAC Name: phenyl 2-ethoxy-4-(1-formamido-3-oxopropyl)-3-hydroxybenzenesulfonate Traditional Name: 2-ethoxy-4-(1-formamido-3-keto-propyl)-3-hydroxy-benzenesulfonic acid phenyl ester Formula: C18H19NO7S MolecularWeight: 393.41096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1O)C(CC=O)NC=O)S(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C=CC(=C1O)C(CC=O)NC=O)S(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C18H19NO7S/c1-2-25-18-16(27(23,24)26-13-6-4-3-5-7-13)9-8-14(17(18)22)15(10-11-20)19-12-21/h3-9,11-12,15,22H,2,10H2,1H3,(H,19,21)