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

Systemtic Name: 7-methoxy-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine Openeye Name: 7-methoxy-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine CAS Name: 7-methoxy-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-methoxy-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine Traditional Name: 7-methoxy-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OC)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OC)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4/c1-29-17-9-5-15(6-10-17)22-23-20-12-11-18(30-2)13-19(20)21(24-25-22)14-3-7-16(8-4-14)26(27)28/h3-13,24H,1-2H3