[4-[2-ethoxycarbonyl-3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]phenyl]sulfamic acid

Systemtic Name: [4-[2-ethoxycarbonyl-3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]phenyl]sulfamic acid Openeye Name: [4-[2-(benzyloxycarbonylamino)-2-ethoxycarbonyl-3-methoxy-3-oxo-propyl]phenyl]sulfamic acid CAS Name: [4-[2-ethoxycarbonyl-3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]phenyl]sulfamic acid IUPAC Name: [4-[2-ethoxycarbonyl-3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]phenyl]sulfamic acid Traditional Name: [4-[2-(benzyloxycarbonylamino)-2-carbethoxy-3-keto-3-methoxy-propyl]phenyl]sulfamic acid Formula: C21H24N2O9S MolecularWeight: 480.48826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)NS(=O)(=O)O)(C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)NS(=O)(=O)O)(C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O9S/c1-3-31-19(25)21(18(24)30-2,22-20(26)32-14-16-7-5-4-6-8-16)13-15-9-11-17(12-10-15)23-33(27,28)29/h4-12,23H,3,13-14H2,1-2H3,(H,22,26)(H,27,28,29)