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

Systemtic Name: 2-azanyl-4-(4-octoxyphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-octoxyphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-octoxyphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-octoxyphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-octoxyphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C30H35N3O MolecularWeight: 453.6184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=NC3=C2CC(CC3)C4=CC=CC=C4)N)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=NC3=C2CC(CC3)C4=CC=CC=C4)N)C#N

InChI

InChI=1S/C30H35N3O/c1-2-3-4-5-6-10-19-34-25-16-13-23(14-17-25)29-26-20-24(22-11-8-7-9-12-22)15-18-28(26)33-30(32)27(29)21-31/h7-9,11-14,16-17,24H,2-6,10,15,18-20H2,1H3,(H2,32,33)