2-(3,4-dimethylphenyl)-N-[1-(phenylmethyl)piperidin-4-yl]quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[1-(phenylmethyl)piperidin-4-yl]quinoline-4-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[1-(phenylmethyl)-4-piperidinyl]-4-quinolinecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-(3,4-dimethylphenyl)cinchoninamide Formula: C30H31N3O MolecularWeight: 449.58664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCN(CC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCN(CC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C30H31N3O/c1-21-12-13-24(18-22(21)2)29-19-27(26-10-6-7-11-28(26)32-29)30(34)31-25-14-16-33(17-15-25)20-23-8-4-3-5-9-23/h3-13,18-19,25H,14-17,20H2,1-2H3,(H,31,34)