N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-[(4-isopentyloxy-3-methoxy-phenyl)methyl]-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-(4-isoamoxy-3-methoxy-benzyl)-1-pyrazin-2-yl-nipecotamide Formula: C23H32N4O3 MolecularWeight: 412.52518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)CNC(=O)C2CCCN(C2)C3=NC=CN=C3)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)CNC(=O)C2CCCN(C2)C3=NC=CN=C3)OC

InChI

InChI=1S/C23H32N4O3/c1-17(2)8-12-30-20-7-6-18(13-21(20)29-3)14-26-23(28)19-5-4-11-27(16-19)22-15-24-9-10-25-22/h6-7,9-10,13,15,17,19H,4-5,8,11-12,14,16H2,1-3H3,(H,26,28)