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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 3-(3,4-dimethoxyphenyl)-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 3-(3,4-dimethoxyphenyl)-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 3-(3,4-dimethoxyphenyl)-1-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-(3,4-dimethoxyphenyl)-1-methyl-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O2/c1-19-16-12(6-4-5-9-17-16)15(18-19)11-7-8-13(20-2)14(10-11)21-3/h7-8,10,18H,4-6,9H2,1-3H3