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5-(3,4-dimethoxyphenyl)-7-ethoxy-2-(4-ethoxyphenyl)-4H-1,3,4-benzotriazepine

5-(3,4-dimethoxyphenyl)-7-ethoxy-2-(4-ethoxyphenyl)-4H-1,3,4-benzotriazepine

Systemtic Name:5-(3,4-dimethoxyphenyl)-7-ethoxy-2-(4-ethoxyphenyl)-4H-1,3,4-benzotriazepine
Openeye Name:5-(3,4-dimethoxyphenyl)-7-ethoxy-2-(4-ethoxyphenyl)-4H-1,3,4-benzotriazepine
CAS Name:5-(3,4-dimethoxyphenyl)-7-ethoxy-2-(4-ethoxyphenyl)-4H-1,3,4-benzotriazepine
IUPAC Name:5-(3,4-dimethoxyphenyl)-7-ethoxy-2-(4-ethoxyphenyl)-4H-1,3,4-benzotriazepine
Traditional Name:5-(3,4-dimethoxyphenyl)-7-ethoxy-2-p-phenetyl-4H-1,3,4-benzotriazepine
Formula: C26H27N3O4
MolecularWeight: 445.51028
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OCC)C4=CC(=C(C=C4)OC)OC


Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OCC)C4=CC(=C(C=C4)OC)OC


InChI

InChI=1S/C26H27N3O4/c1-5-32-19-10-7-17(8-11-19)26-27-22-13-12-20(33-6-2)16-21(22)25(28-29-26)18-9-14-23(30-3)24(15-18)31-4/h7-16,28H,5-6H2,1-4H3


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