2-azanyl-1-(4-bromanyl-2-fluoranyl-phenyl)-4-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(4-bromanyl-2-fluoranyl-phenyl)-4-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(4-bromo-2-fluoro-phenyl)-4-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(4-bromo-2-fluorophenyl)-4-[4-methoxy-3-(1-pyrrolidinylmethyl)phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-bromo-2-fluorophenyl)-4-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(4-bromo-2-fluoro-phenyl)-5-keto-4-[4-methoxy-3-(pyrrolidinomethyl)phenyl]-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C30H32BrFN4O2 MolecularWeight: 579.503083

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=C(C=C(C=C3)Br)F)N)C#N)C4=CC(=C(C=C4)OC)CN5CCCC5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=C(C=C(C=C3)Br)F)N)C#N)C4=CC(=C(C=C4)OC)CN5CCCC5)C(=O)C1)C

InChI

InChI=1S/C30H32BrFN4O2/c1-30(2)14-24-28(25(37)15-30)27(18-6-9-26(38-3)19(12-18)17-35-10-4-5-11-35)21(16-33)29(34)36(24)23-8-7-20(31)13-22(23)32/h6-9,12-13,27H,4-5,10-11,14-15,17,34H2,1-3H3