azane; 4-[[2-azanyl-1-[4-(2-chloranyl-1-phenyl-ethoxy)-3-methoxy-phenyl]ethyl]amino]benzenecarbonitrile

Systemtic Name: azane; 4-[[2-azanyl-1-[4-(2-chloranyl-1-phenyl-ethoxy)-3-methoxy-phenyl]ethyl]amino]benzenecarbonitrile Openeye Name: 4-[[2-amino-1-[4-(2-chloro-1-phenyl-ethoxy)-3-methoxy-phenyl]ethyl]amino]benzonitrile; ammonia CAS Name: 4-[[2-amino-1-[4-(2-chloro-1-phenylethoxy)-3-methoxyphenyl]ethyl]amino]benzonitrile; ammonia IUPAC Name: 4-[[2-amino-1-[4-(2-chloro-1-phenylethoxy)-3-methoxyphenyl]ethyl]amino]benzonitrile; azane Traditional Name: 4-[[2-amino-1-[4-(2-chloro-1-phenyl-ethoxy)-3-methoxy-phenyl]ethyl]amino]benzonitrile; ammonia Formula: C24H27ClN4O2 MolecularWeight: 438.94978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(CN)NC2=CC=C(C=C2)C#N)OC(CCl)C3=CC=CC=C3.N

Isomeric SMILES

COC1=C(C=CC(=C1)C(CN)NC2=CC=C(C=C2)C#N)OC(CCl)C3=CC=CC=C3.N

InChI

InChI=1S/C24H24ClN3O2.H3N/c1-29-23-13-19(21(16-27)28-20-10-7-17(15-26)8-11-20)9-12-22(23)30-24(14-25)18-5-3-2-4-6-18;/h2-13,21,24,28H,14,16,27H2,1H3;1H3