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

Systemtic Name: 2-azanyl-6-phenyl-4-(3-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(3-benzyloxyphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-6-phenyl-4-(3-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-6-phenyl-4-(3-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(3-benzoxyphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C29H25N3O MolecularWeight: 431.5283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C3=CC=CC=C3)C(=C(C(=N2)N)C#N)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CC2=C(CC1C3=CC=CC=C3)C(=C(C(=N2)N)C#N)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H25N3O/c30-18-26-28(23-12-7-13-24(16-23)33-19-20-8-3-1-4-9-20)25-17-22(21-10-5-2-6-11-21)14-15-27(25)32-29(26)31/h1-13,16,22H,14-15,17,19H2,(H2,31,32)