[2-(3-methoxyphenyl)-2-[1-(2-methoxyphenyl)piperidin-4-yl]ethanoyl]sulfamic acid

Systemtic Name: [2-(3-methoxyphenyl)-2-[1-(2-methoxyphenyl)piperidin-4-yl]ethanoyl]sulfamic acid Openeye Name: [2-(3-methoxyphenyl)-2-[1-(2-methoxyphenyl)-4-piperidyl]acetyl]sulfamic acid CAS Name: [2-(3-methoxyphenyl)-2-[1-(2-methoxyphenyl)-4-piperidinyl]-1-oxoethyl]sulfamic acid IUPAC Name: [2-(3-methoxyphenyl)-2-[1-(2-methoxyphenyl)piperidin-4-yl]acetyl]sulfamic acid Traditional Name: [2-(3-methoxyphenyl)-2-[1-(2-methoxyphenyl)-4-piperidyl]acetyl]sulfamic acid Formula: C21H26N2O6S MolecularWeight: 434.50594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2CCN(CC2)C3=CC=CC=C3OC)C(=O)NS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(C2CCN(CC2)C3=CC=CC=C3OC)C(=O)NS(=O)(=O)O

InChI

InChI=1S/C21H26N2O6S/c1-28-17-7-5-6-16(14-17)20(21(24)22-30(25,26)27)15-10-12-23(13-11-15)18-8-3-4-9-19(18)29-2/h3-9,14-15,20H,10-13H2,1-2H3,(H,22,24)(H,25,26,27)