N-(5-chloranyl-2-methyl-phenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(4-benzyloxyphenyl)-N-(5-chloro-2-methyl-phenyl)-3,6,8-trimethyl-quinoline-4-carboxamide CAS Name: N-(5-chloro-2-methylphenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-(5-chloro-2-methylphenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide Traditional Name: 2-(4-benzoxyphenyl)-N-(5-chloro-2-methyl-phenyl)-3,6,8-trimethyl-cinchoninamide Formula: C33H29ClN2O2 MolecularWeight: 521.04856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)OCC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C33H29ClN2O2/c1-20-16-22(3)31-28(17-20)30(33(37)35-29-18-26(34)13-10-21(29)2)23(4)32(36-31)25-11-14-27(15-12-25)38-19-24-8-6-5-7-9-24/h5-18H,19H2,1-4H3,(H,35,37)