1-(5-chloranyl-2-methoxy-phenyl)-3-(piperidin-1-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-(piperidin-1-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(1-piperidylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-(1-piperidinylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-(piperidin-1-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-(piperidinomethyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C20H27ClN4O MolecularWeight: 374.90758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C3=NCCCCC3=C(N2)CN4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C3=NCCCCC3=C(N2)CN4CCCCC4

InChI

InChI=1S/C20H27ClN4O/c1-26-19-9-8-15(21)13-18(19)25-20-16(7-3-4-10-22-20)17(23-25)14-24-11-5-2-6-12-24/h8-9,13,23H,2-7,10-12,14H2,1H3