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

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C17H16BrN3O MolecularWeight: 358.23244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=NC3=C2CCCC3)N)C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=NC3=C2CCCC3)N)C#N)Br

InChI

InChI=1S/C17H16BrN3O/c1-22-15-7-6-10(8-13(15)18)16-11-4-2-3-5-14(11)21-17(20)12(16)9-19/h6-8H,2-5H2,1H3,(H2,20,21)