8-chloranyl-2-(4-ethoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine

Systemtic Name: 8-chloranyl-2-(4-ethoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine Openeye Name: 8-chloro-2-(4-ethoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine CAS Name: 8-chloro-2-(4-ethoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine IUPAC Name: 8-chloro-2-(4-ethoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine Traditional Name: 8-chloro-4-phenyl-2-p-phenetyl-1H-1,3,5-benzotriazepine Formula: C22H18ClN3O MolecularWeight: 375.85082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=NC3=C(N2)C=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=NC3=C(N2)C=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H18ClN3O/c1-2-27-18-11-8-16(9-12-18)22-25-20-14-17(23)10-13-19(20)24-21(26-22)15-6-4-3-5-7-15/h3-14H,2H2,1H3,(H,24,25,26)