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

Systemtic Name: [4-[3-methoxy-2-methoxycarbonyl-2-[(3-methoxyphenyl)methyl]-3-oxidanylidene-propyl]phenyl]sulfamic acid Openeye Name: [4-[3-methoxy-2-methoxycarbonyl-2-[(3-methoxyphenyl)methyl]-3-oxo-propyl]phenyl]sulfamic acid CAS Name: [4-[3-methoxy-2-methoxycarbonyl-2-[(3-methoxyphenyl)methyl]-3-oxopropyl]phenyl]sulfamic acid IUPAC Name: [4-[3-methoxy-2-methoxycarbonyl-2-[(3-methoxyphenyl)methyl]-3-oxopropyl]phenyl]sulfamic acid Traditional Name: [4-(2-carbomethoxy-3-keto-2-m-anisyl-3-methoxy-propyl)phenyl]sulfamic acid Formula: C20H23NO8S MolecularWeight: 437.46352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC(CC2=CC=C(C=C2)NS(=O)(=O)O)(C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)CC(CC2=CC=C(C=C2)NS(=O)(=O)O)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H23NO8S/c1-27-17-6-4-5-15(11-17)13-20(18(22)28-2,19(23)29-3)12-14-7-9-16(10-8-14)21-30(24,25)26/h4-11,21H,12-13H2,1-3H3,(H,24,25,26)