1-(2-ethoxyphenyl)-3-propan-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-(2-ethoxyphenyl)-3-propan-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(2-ethoxyphenyl)-3-isopropyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(2-ethoxyphenyl)-3-propan-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(2-ethoxyphenyl)-3-propan-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-isopropyl-1-o-phenetyl-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C18H25N3O MolecularWeight: 299.4106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C3=NCCCCC3=C(N2)C(C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2C3=NCCCCC3=C(N2)C(C)C

InChI

InChI=1S/C18H25N3O/c1-4-22-16-11-6-5-10-15(16)21-18-14(9-7-8-12-19-18)17(20-21)13(2)3/h5-6,10-11,13,20H,4,7-9,12H2,1-3H3