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

Systemtic Name: 1-(2-chlorophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(2-chlorophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(2-chlorophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(2-chlorophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(2-chlorophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C16H20ClN3 MolecularWeight: 289.8031

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2CCCCN=C2N(N1)C3=CC=CC=C3Cl

Isomeric SMILES

CCCC1=C2CCCCN=C2N(N1)C3=CC=CC=C3Cl

InChI

InChI=1S/C16H20ClN3/c1-2-7-14-12-8-5-6-11-18-16(12)20(19-14)15-10-4-3-9-13(15)17/h3-4,9-10,19H,2,5-8,11H2,1H3