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

Systemtic Name: 2-azanyl-4-(4-butoxy-3-methoxy-phenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-butoxy-3-methoxy-phenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-butoxy-3-methoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-butoxy-3-methoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-butoxy-3-methoxy-phenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2=C(C(=NC3=C2CCCC3)N)C#N)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2=C(C(=NC3=C2CCCC3)N)C#N)OC

InChI

InChI=1S/C21H25N3O2/c1-3-4-11-26-18-10-9-14(12-19(18)25-2)20-15-7-5-6-8-17(15)24-21(23)16(20)13-22/h9-10,12H,3-8,11H2,1-2H3,(H2,23,24)