5-(4-chlorophenyl)-7-methoxy-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine

Systemtic Name: 5-(4-chlorophenyl)-7-methoxy-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine Openeye Name: 5-(4-chlorophenyl)-7-methoxy-2-(p-tolyl)-4H-1,3,4-benzotriazepine CAS Name: 5-(4-chlorophenyl)-7-methoxy-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 5-(4-chlorophenyl)-7-methoxy-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine Traditional Name: 5-(4-chlorophenyl)-7-methoxy-2-(p-tolyl)-4H-1,3,4-benzotriazepine Formula: C22H18ClN3O MolecularWeight: 375.85082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OC)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OC)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3O/c1-14-3-5-16(6-4-14)22-24-20-12-11-18(27-2)13-19(20)21(25-26-22)15-7-9-17(23)10-8-15/h3-13,25H,1-2H3