2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C19H20BrN3O MolecularWeight: 386.2856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CCC1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C19H20BrN3O/c1-3-11-4-6-16-13(8-11)18(14(10-21)19(22)23-16)12-5-7-17(24-2)15(20)9-12/h5,7,9,11H,3-4,6,8H2,1-2H3,(H2,22,23)