7-methoxy-2-(4-methoxyphenyl)-5-pyridin-3-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-methoxy-2-(4-methoxyphenyl)-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-methoxy-2-(4-methoxyphenyl)-5-(3-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-methoxy-2-(4-methoxyphenyl)-5-(3-pyridinyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-methoxy-2-(4-methoxyphenyl)-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-methoxy-2-(4-methoxyphenyl)-5-(3-pyridyl)-4H-1,3,4-benzotriazepine Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N4O2/c1-26-16-7-5-14(6-8-16)21-23-19-10-9-17(27-2)12-18(19)20(24-25-21)15-4-3-11-22-13-15/h3-13,24H,1-2H3