2-azanyl-1-(4-bromophenyl)-7,7-dimethyl-5-oxidanylidene-4-(4-prop-2-enoxyphenyl)-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(4-bromophenyl)-7,7-dimethyl-5-oxidanylidene-4-(4-prop-2-enoxyphenyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 4-(4-allyloxyphenyl)-2-amino-1-(4-bromophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(4-bromophenyl)-7,7-dimethyl-5-oxo-4-(4-prop-2-enoxyphenyl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-bromophenyl)-7,7-dimethyl-5-oxo-4-(4-prop-2-enoxyphenyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 4-(4-allyloxyphenyl)-2-amino-1-(4-bromophenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C27H26BrN3O2 MolecularWeight: 504.41824

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)Br)N)C#N)C4=CC=C(C=C4)OCC=C)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)Br)N)C#N)C4=CC=C(C=C4)OCC=C)C(=O)C1)C

InChI

InChI=1S/C27H26BrN3O2/c1-4-13-33-20-11-5-17(6-12-20)24-21(16-29)26(30)31(19-9-7-18(28)8-10-19)22-14-27(2,3)15-23(32)25(22)24/h4-12,24H,1,13-15,30H2,2-3H3