2-azanyl-4-(3-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(3-benzyloxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(3-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(3-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(3-benzoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H21N3O MolecularWeight: 355.43234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O/c24-14-20-22(19-11-4-5-12-21(19)26-23(20)25)17-9-6-10-18(13-17)27-15-16-7-2-1-3-8-16/h1-3,6-10,13H,4-5,11-12,15H2,(H2,25,26)