8-chloranyl-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine

Systemtic Name: 8-chloranyl-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine Openeye Name: 8-chloro-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine CAS Name: 8-chloro-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine IUPAC Name: 8-chloro-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine Traditional Name: 8-chloro-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine Formula: C21H16ClN3O MolecularWeight: 361.82424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NC3=C(N2)C=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NC3=C(N2)C=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H16ClN3O/c1-26-17-10-7-15(8-11-17)21-24-19-13-16(22)9-12-18(19)23-20(25-21)14-5-3-2-4-6-14/h2-13H,1H3,(H,23,24,25)