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

Systemtic Name: 3-[(3-methoxyphenyl)methyl]-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 3-[(3-methoxyphenyl)methyl]-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 3-[(3-methoxyphenyl)methyl]-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 3-[(3-methoxyphenyl)methyl]-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-m-anisyl-1-methyl-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C16H21N3O MolecularWeight: 271.35744

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NCCCCC2=C(N1)CC3=CC(=CC=C3)OC

Isomeric SMILES

CN1C2=NCCCCC2=C(N1)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C16H21N3O/c1-19-16-14(8-3-4-9-17-16)15(18-19)11-12-6-5-7-13(10-12)20-2/h5-7,10,18H,3-4,8-9,11H2,1-2H3