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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-propan-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-isopropyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(3-chloro-4-methylphenyl)-3-propan-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-propan-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-isopropyl-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C17H22ClN3 MolecularWeight: 303.82968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=NCCCCC3=C(N2)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=NCCCCC3=C(N2)C(C)C)Cl

InChI

InChI=1S/C17H22ClN3/c1-11(2)16-14-6-4-5-9-19-17(14)21(20-16)13-8-7-12(3)15(18)10-13/h7-8,10-11,20H,4-6,9H2,1-3H3