phenyl 6-ethoxy-3-(1-formamido-3-oxidanylidene-propyl)-2-methoxy-benzenesulfonate

Systemtic Name: phenyl 6-ethoxy-3-(1-formamido-3-oxidanylidene-propyl)-2-methoxy-benzenesulfonate Openeye Name: phenyl 6-ethoxy-3-(1-formamido-3-oxo-propyl)-2-methoxy-benzenesulfonate CAS Name: 6-ethoxy-3-(1-formamido-3-oxopropyl)-2-methoxybenzenesulfonic acid phenyl ester IUPAC Name: phenyl 6-ethoxy-3-(1-formamido-3-oxopropyl)-2-methoxybenzenesulfonate Traditional Name: 6-ethoxy-3-(1-formamido-3-keto-propyl)-2-methoxy-benzenesulfonic acid phenyl ester Formula: C19H21NO7S MolecularWeight: 407.43754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C=C1)C(CC=O)NC=O)OC)S(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=C(C=C1)C(CC=O)NC=O)OC)S(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C19H21NO7S/c1-3-26-17-10-9-15(16(11-12-21)20-13-22)18(25-2)19(17)28(23,24)27-14-7-5-4-6-8-14/h4-10,12-13,16H,3,11H2,1-2H3,(H,20,22)