[4-[3-methoxy-2-methoxycarbonyl-3-oxidanylidene-2-(phenylmethyl)propyl]phenyl]sulfamic acid

Systemtic Name: [4-[3-methoxy-2-methoxycarbonyl-3-oxidanylidene-2-(phenylmethyl)propyl]phenyl]sulfamic acid Openeye Name: [4-(2-benzyl-3-methoxy-2-methoxycarbonyl-3-oxo-propyl)phenyl]sulfamic acid CAS Name: [4-[3-methoxy-2-methoxycarbonyl-3-oxo-2-(phenylmethyl)propyl]phenyl]sulfamic acid IUPAC Name: [4-(2-benzyl-3-methoxy-2-methoxycarbonyl-3-oxopropyl)phenyl]sulfamic acid Traditional Name: [4-(2-benzyl-2-carbomethoxy-3-keto-3-methoxy-propyl)phenyl]sulfamic acid Formula: C19H21NO7S MolecularWeight: 407.43754

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)(CC2=CC=C(C=C2)NS(=O)(=O)O)C(=O)OC

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)(CC2=CC=C(C=C2)NS(=O)(=O)O)C(=O)OC

InChI

InChI=1S/C19H21NO7S/c1-26-17(21)19(18(22)27-2,12-14-6-4-3-5-7-14)13-15-8-10-16(11-9-15)20-28(23,24)25/h3-11,20H,12-13H2,1-2H3,(H,23,24,25)