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

Systemtic Name: 3-[(2-methoxyphenyl)methyl]-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 3-[(2-methoxyphenyl)methyl]-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 3-[(2-methoxyphenyl)methyl]-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 3-[(2-methoxyphenyl)methyl]-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-methyl-3-o-anisyl-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=C3OC

Isomeric SMILES

CN1C2=NCCCCC2=C(N1)CC3=CC=CC=C3OC

InChI

InChI=1S/C16H21N3O/c1-19-16-13(8-5-6-10-17-16)14(18-19)11-12-7-3-4-9-15(12)20-2/h3-4,7,9,18H,5-6,8,10-11H2,1-2H3