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

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]quinoline-4-carboxamide Openeye Name: N-[3-(4-benzyl-1-piperidyl)propyl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]-4-quinolinecarboxamide IUPAC Name: N-[3-(4-benzylpiperidin-1-yl)propyl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-[3-(4-benzylpiperidino)propyl]-2-(3,4-dimethylphenyl)cinchoninamide Formula: C33H37N3O MolecularWeight: 491.66638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCC(CC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCC(CC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C33H37N3O/c1-24-13-14-28(21-25(24)2)32-23-30(29-11-6-7-12-31(29)35-32)33(37)34-17-8-18-36-19-15-27(16-20-36)22-26-9-4-3-5-10-26/h3-7,9-14,21,23,27H,8,15-20,22H2,1-2H3,(H,34,37)