3-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamide

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamide Openeye Name: 3-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamide CAS Name: 3-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamide IUPAC Name: 3-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamide Traditional Name: 3-p-anisyl-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine-1-carboxamide Formula: C16H20N4O2 MolecularWeight: 300.3556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C3CCCCN=C3N(N2)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C3CCCCN=C3N(N2)C(=O)N

InChI

InChI=1S/C16H20N4O2/c1-22-12-7-5-11(6-8-12)10-14-13-4-2-3-9-18-15(13)20(19-14)16(17)21/h5-8,19H,2-4,9-10H2,1H3,(H2,17,21)