1-(3,4-dimethylphenyl)-3-naphthalen-1-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-(3,4-dimethylphenyl)-3-naphthalen-1-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(3,4-dimethylphenyl)-3-(1-naphthyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(3,4-dimethylphenyl)-3-(1-naphthalenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(3,4-dimethylphenyl)-3-naphthalen-1-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(3,4-dimethylphenyl)-3-(1-naphthyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C25H25N3 MolecularWeight: 367.4861

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=NCCCCC3=C(N2)C4=CC=CC5=CC=CC=C54)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=NCCCCC3=C(N2)C4=CC=CC5=CC=CC=C54)C

InChI

InChI=1S/C25H25N3/c1-17-13-14-20(16-18(17)2)28-25-23(11-5-6-15-26-25)24(27-28)22-12-7-9-19-8-3-4-10-21(19)22/h3-4,7-10,12-14,16,27H,5-6,11,15H2,1-2H3