2-azanyl-4-[5-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]-2,4-dimethyl-phenyl]-1-(4-methoxy-2-nitro-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-[5-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]-2,4-dimethyl-phenyl]-1-(4-methoxy-2-nitro-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-[5-[(2-chloro-4-fluoro-phenoxy)methyl]-2,4-dimethyl-phenyl]-1-(4-methoxy-2-nitro-phenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl]-1-(4-methoxy-2-nitrophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-[5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl]-1-(4-methoxy-2-nitrophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[5-[(2-chloro-4-fluoro-phenoxy)methyl]-2,4-dimethyl-phenyl]-5-keto-1-(4-methoxy-2-nitro-phenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C32H28ClFN4O5 MolecularWeight: 603.039923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=C(C=C4)OC)[N+](=O)[O-])N)C#N)COC5=C(C=C(C=C5)F)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=C(C=C4)OC)[N+](=O)[O-])N)C#N)COC5=C(C=C(C=C5)F)Cl)C

InChI

InChI=1S/C32H28ClFN4O5/c1-17-11-18(2)22(12-19(17)16-43-29-10-7-20(34)13-24(29)33)30-23(15-35)32(36)37(26-5-4-6-28(39)31(26)30)25-9-8-21(42-3)14-27(25)38(40)41/h7-14,30H,4-6,16,36H2,1-3H3