N-[3-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]-1-phenyl-propyl]-2-phenoxy-pyridine-3-carboxamide

Systemtic Name: N-[3-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]-1-phenyl-propyl]-2-phenoxy-pyridine-3-carboxamide Openeye Name: N-[3-[4-[3-(2-methylpropanoylamino)phenyl]-1-piperidyl]-1-phenyl-propyl]-2-phenoxy-pyridine-3-carboxamide CAS Name: N-[3-[4-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-1-piperidinyl]-1-phenylpropyl]-2-phenoxy-3-pyridinecarboxamide IUPAC Name: N-[3-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]-1-phenylpropyl]-2-phenoxypyridine-3-carboxamide Traditional Name: N-[3-[4-[3-(isobutyrylamino)phenyl]piperidino]-1-phenyl-propyl]-2-phenoxy-nicotinamide Formula: C36H40N4O3 MolecularWeight: 576.7278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCC(C3=CC=CC=C3)NC(=O)C4=C(N=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCC(C3=CC=CC=C3)NC(=O)C4=C(N=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C36H40N4O3/c1-26(2)34(41)38-30-14-9-13-29(25-30)27-18-22-40(23-19-27)24-20-33(28-11-5-3-6-12-28)39-35(42)32-17-10-21-37-36(32)43-31-15-7-4-8-16-31/h3-17,21,25-27,33H,18-20,22-24H2,1-2H3,(H,38,41)(H,39,42)