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

Systemtic Name: 2-azanyl-4-[3-bromanyl-4-(cyanomethoxy)-5-methoxy-phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-[3-bromo-4-(cyanomethoxy)-5-methoxy-phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[3-bromo-4-(cyanomethoxy)-5-methoxy-phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C19H17BrN4O2 MolecularWeight: 413.26788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN4O2/c1-25-16-9-11(8-14(20)18(16)26-7-6-21)17-12-4-2-3-5-15(12)24-19(23)13(17)10-22/h8-9H,2-5,7H2,1H3,(H2,23,24)