2-azanyl-4-(1,3-benzodioxol-5-yl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(1,3-benzodioxol-5-yl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H19N3O2 MolecularWeight: 369.41586

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C3=CC=CC=C3)C(=C(C(=N2)N)C#N)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC2=C(CC1C3=CC=CC=C3)C(=C(C(=N2)N)C#N)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H19N3O2/c24-12-18-22(16-7-9-20-21(11-16)28-13-27-20)17-10-15(14-4-2-1-3-5-14)6-8-19(17)26-23(18)25/h1-5,7,9,11,15H,6,8,10,13H2,(H2,25,26)