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

Systemtic Name: 7-ethyl-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine Openeye Name: 7-ethyl-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine CAS Name: 7-ethyl-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-ethyl-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine Traditional Name: 7-ethyl-2-(4-methoxyphenyl)-5-(4-nitrophenyl)-4H-1,3,4-benzotriazepine Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O3/c1-3-15-4-13-21-20(14-15)22(16-5-9-18(10-6-16)27(28)29)25-26-23(24-21)17-7-11-19(30-2)12-8-17/h4-14,25H,3H2,1-2H3