[3-[4-oxidanyl-1-(5-phenethylpyridin-3-yl)carbonyl-piperidin-4-yl]phenyl]methylcarbamic acid

Systemtic Name: [3-[4-oxidanyl-1-(5-phenethylpyridin-3-yl)carbonyl-piperidin-4-yl]phenyl]methylcarbamic acid Openeye Name: [3-[4-hydroxy-1-(5-phenethylpyridine-3-carbonyl)-4-piperidyl]phenyl]methylcarbamic acid CAS Name: [3-[4-hydroxy-1-[oxo-(5-phenethyl-3-pyridinyl)methyl]-4-piperidinyl]phenyl]methylcarbamic acid IUPAC Name: [3-[4-hydroxy-1-(5-phenethylpyridine-3-carbonyl)piperidin-4-yl]phenyl]methylcarbamic acid Traditional Name: [3-[4-hydroxy-1-(5-phenethylnicotinoyl)-4-piperidyl]benzyl]carbamic acid Formula: C27H29N3O4 MolecularWeight: 459.53686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC(=CC=C2)CNC(=O)O)O)C(=O)C3=CC(=CN=C3)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1(C2=CC(=CC=C2)CNC(=O)O)O)C(=O)C3=CC(=CN=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4/c31-25(23-15-22(17-28-19-23)10-9-20-5-2-1-3-6-20)30-13-11-27(34,12-14-30)24-8-4-7-21(16-24)18-29-26(32)33/h1-8,15-17,19,29,34H,9-14,18H2,(H,32,33)