N-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxidanyl-propyl]-2-phenoxy-pyridine-3-carboxamide

Systemtic Name: N-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxidanyl-propyl]-2-phenoxy-pyridine-3-carboxamide Openeye Name: N-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-hydroxy-propyl]-2-phenoxy-pyridine-3-carboxamide CAS Name: N-[3-[4-(2-ethoxyphenyl)-1-piperazinyl]-2-hydroxypropyl]-2-phenoxy-3-pyridinecarboxamide IUPAC Name: N-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-hydroxypropyl]-2-phenoxypyridine-3-carboxamide Traditional Name: N-[2-hydroxy-3-(4-o-phenetylpiperazino)propyl]-2-phenoxy-nicotinamide Formula: C27H32N4O4 MolecularWeight: 476.56738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)CC(CNC(=O)C3=C(N=CC=C3)OC4=CC=CC=C4)O

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)CC(CNC(=O)C3=C(N=CC=C3)OC4=CC=CC=C4)O

InChI

InChI=1S/C27H32N4O4/c1-2-34-25-13-7-6-12-24(25)31-17-15-30(16-18-31)20-21(32)19-29-26(33)23-11-8-14-28-27(23)35-22-9-4-3-5-10-22/h3-14,21,32H,2,15-20H2,1H3,(H,29,33)