5-(4-chlorophenyl)-2-(4-methoxyphenyl)-4H-1,3,4-benzotriazepine

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=C3C=CC=CC3=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=C3C=CC=CC3=N2)C4=CC=C(C=C4)Cl

InChI

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