1-[(8-methoxy-2H-chromen-3-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(8-methoxy-2H-chromen-3-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide Openeye Name: 1-[(8-methoxy-2H-chromen-3-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide CAS Name: 1-[(8-methoxy-2H-1-benzopyran-3-yl)methyl]-N-[4-(1-pyrazolyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(8-methoxy-2H-chromen-3-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide Traditional Name: 1-[(8-methoxy-2H-chromen-3-yl)methyl]-N-(4-pyrazol-1-ylphenyl)isonipecotamide Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OCC(=C2)CN3CCC(CC3)C(=O)NC4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

COC1=CC=CC2=C1OCC(=C2)CN3CCC(CC3)C(=O)NC4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C26H28N4O3/c1-32-24-5-2-4-21-16-19(18-33-25(21)24)17-29-14-10-20(11-15-29)26(31)28-22-6-8-23(9-7-22)30-13-3-12-27-30/h2-9,12-13,16,20H,10-11,14-15,17-18H2,1H3,(H,28,31)