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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamide Openeye Name: 3-(3,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamide CAS Name: 3-(3,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamide Traditional Name: 3-(3,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine-1-carboxamide Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C3CCCCN=C3N(N2)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C3CCCCN=C3N(N2)C(=O)N)OC

InChI

InChI=1S/C16H20N4O3/c1-22-12-7-6-10(9-13(12)23-2)14-11-5-3-4-8-18-15(11)20(19-14)16(17)21/h6-7,9,19H,3-5,8H2,1-2H3,(H2,17,21)