4-[1-(3-chloranyl-2-methyl-phenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]-N,N-dimethyl-aniline

Systemtic Name: 4-[1-(3-chloranyl-2-methyl-phenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]-N,N-dimethyl-aniline Openeye Name: 4-[1-(3-chloro-2-methyl-phenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]-N,N-dimethyl-aniline CAS Name: 4-[1-(3-chloro-2-methylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]-N,N-dimethylaniline IUPAC Name: 4-[1-(3-chloro-2-methylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]-N,N-dimethylaniline Traditional Name: [4-[1-(3-chloro-2-methyl-phenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepin-3-yl]phenyl]-dimethyl-amine Formula: C22H25ClN4 MolecularWeight: 380.9137

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C3=NCCCCC3=C(N2)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C3=NCCCCC3=C(N2)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C22H25ClN4/c1-15-19(23)8-6-9-20(15)27-22-18(7-4-5-14-24-22)21(25-27)16-10-12-17(13-11-16)26(2)3/h6,8-13,25H,4-5,7,14H2,1-3H3