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

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide Openeye Name: 3-(5-chloro-2-methoxy-phenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamidine CAS Name: 3-(5-chloro-2-methoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide IUPAC Name: 3-(5-chloro-2-methoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide Traditional Name: 3-(5-chloro-2-methoxy-phenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine-1-carboxamidine Formula: C15H18ClN5O MolecularWeight: 319.78932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=C3CCCCN=C3N(N2)C(=N)N

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=C3CCCCN=C3N(N2)C(=N)N

InChI

InChI=1S/C15H18ClN5O/c1-22-12-6-5-9(16)8-11(12)13-10-4-2-3-7-19-14(10)21(20-13)15(17)18/h5-6,8,20H,2-4,7H2,1H3,(H3,17,18)