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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(4-benzyloxyphenyl)-N-(3-chloro-2-methyl-phenyl)-3,6,8-trimethyl-quinoline-4-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide Traditional Name: 2-(4-benzoxyphenyl)-N-(3-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=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)NC5=C(C(=CC=C5)Cl)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)NC5=C(C(=CC=C5)Cl)C)C

InChI

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