N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-4-methoxy-quinoline-2-carboxamide

Systemtic Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-4-methoxy-quinoline-2-carboxamide Openeye Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-4-methoxy-quinoline-2-carboxamide CAS Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-4-methoxy-2-quinolinecarboxamide IUPAC Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-4-methoxyquinoline-2-carboxamide Traditional Name: N-(3-cyano-4-neopentyloxy-phenyl)-4-methoxy-quinaldamide Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC1=C(C=C(C=C1)NC(=O)C2=NC3=CC=CC=C3C(=C2)OC)C#N

Isomeric SMILES

CC(C)(C)COC1=C(C=C(C=C1)NC(=O)C2=NC3=CC=CC=C3C(=C2)OC)C#N

InChI

InChI=1S/C23H23N3O3/c1-23(2,3)14-29-20-10-9-16(11-15(20)13-24)25-22(27)19-12-21(28-4)17-7-5-6-8-18(17)26-19/h5-12H,14H2,1-4H3,(H,25,27)