4-(3-bicyclo[3.3.3]undecanyl)-N-(3-chloranyl-4-methoxy-phenyl)quinoline-2-carboxamide

Systemtic Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(3-chloranyl-4-methoxy-phenyl)quinoline-2-carboxamide Openeye Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(3-chloro-4-methoxy-phenyl)quinoline-2-carboxamide CAS Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(3-chloro-4-methoxyphenyl)-2-quinolinecarboxamide IUPAC Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(3-chloro-4-methoxyphenyl)quinoline-2-carboxamide Traditional Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(3-chloro-4-methoxy-phenyl)quinaldamide Formula: C28H31ClN2O2 MolecularWeight: 463.01094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=NC3=CC=CC=C3C(=C2)C4CC5CCCC(C4)CCC5)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=NC3=CC=CC=C3C(=C2)C4CC5CCCC(C4)CCC5)Cl

InChI

InChI=1S/C28H31ClN2O2/c1-33-27-13-12-21(16-24(27)29)30-28(32)26-17-23(22-10-2-3-11-25(22)31-26)20-14-18-6-4-7-19(15-20)9-5-8-18/h2-3,10-13,16-20H,4-9,14-15H2,1H3,(H,30,32)