5-(3,4-diethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine

Systemtic Name: 5-(3,4-diethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine Openeye Name: 5-(3,4-diethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine CAS Name: 5-(3,4-diethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine IUPAC Name: 5-(3,4-diethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine Traditional Name: 5-(3,4-diethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine Formula: C26H27N3O3 MolecularWeight: 429.51088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(NN=C(N=C2C=C1)C3=CC=CC=C3)C4=CC(=C(C=C4)OCC)OCC

Isomeric SMILES

CCOC1=CC2=C(NN=C(N=C2C=C1)C3=CC=CC=C3)C4=CC(=C(C=C4)OCC)OCC

InChI

InChI=1S/C26H27N3O3/c1-4-30-20-13-14-22-21(17-20)25(28-29-26(27-22)18-10-8-7-9-11-18)19-12-15-23(31-5-2)24(16-19)32-6-3/h7-17,28H,4-6H2,1-3H3