[1-[2-(2-methoxyethoxy)phenyl]-4-(3-methoxyphenyl)piperidin-4-yl]carbonylsulfamic acid

Systemtic Name: [1-[2-(2-methoxyethoxy)phenyl]-4-(3-methoxyphenyl)piperidin-4-yl]carbonylsulfamic acid Openeye Name: [1-[2-(2-methoxyethoxy)phenyl]-4-(3-methoxyphenyl)piperidine-4-carbonyl]sulfamic acid CAS Name: [[1-[2-(2-methoxyethoxy)phenyl]-4-(3-methoxyphenyl)-4-piperidinyl]-oxomethyl]sulfamic acid IUPAC Name: [1-[2-(2-methoxyethoxy)phenyl]-4-(3-methoxyphenyl)piperidine-4-carbonyl]sulfamic acid Traditional Name: [1-[2-(2-methoxyethoxy)phenyl]-4-(3-methoxyphenyl)isonipecotoyl]sulfamic acid Formula: C22H28N2O7S MolecularWeight: 464.53192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=CC=C1N2CCC(CC2)(C3=CC(=CC=C3)OC)C(=O)NS(=O)(=O)O

Isomeric SMILES

COCCOC1=CC=CC=C1N2CCC(CC2)(C3=CC(=CC=C3)OC)C(=O)NS(=O)(=O)O

InChI

InChI=1S/C22H28N2O7S/c1-29-14-15-31-20-9-4-3-8-19(20)24-12-10-22(11-13-24,21(25)23-32(26,27)28)17-6-5-7-18(16-17)30-2/h3-9,16H,10-15H2,1-2H3,(H,23,25)(H,26,27,28)