2-azanyl-4-(4-heptoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-heptoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-heptoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-heptoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-heptoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-heptoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C24H31N3O MolecularWeight: 377.52244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=C(C(=NC3=C2CC(CC3)C)N)C#N

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=C(C(=NC3=C2CC(CC3)C)N)C#N

InChI

InChI=1S/C24H31N3O/c1-3-4-5-6-7-14-28-19-11-9-18(10-12-19)23-20-15-17(2)8-13-22(20)27-24(26)21(23)16-25/h9-12,17H,3-8,13-15H2,1-2H3,(H2,26,27)