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

Systemtic Name: 1-(2-methylphenyl)-3-pentan-3-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 3-(1-ethylpropyl)-1-(o-tolyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(2-methylphenyl)-3-pentan-3-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(2-methylphenyl)-3-pentan-3-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-(1-ethylpropyl)-1-(o-tolyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C19H27N3 MolecularWeight: 297.43778

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=C2CCCCN=C2N(N1)C3=CC=CC=C3C

Isomeric SMILES

CCC(CC)C1=C2CCCCN=C2N(N1)C3=CC=CC=C3C

InChI

InChI=1S/C19H27N3/c1-4-15(5-2)18-16-11-8-9-13-20-19(16)22(21-18)17-12-7-6-10-14(17)3/h6-7,10,12,15,21H,4-5,8-9,11,13H2,1-3H3