4-[(3-chloranyl-4-methoxy-phenyl)methylamino]quinoline-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]quinoline-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]quinoline-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-3-quinolinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]quinoline-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]quinoline-3-carboxamide Formula: C18H16ClN3O2 MolecularWeight: 341.79154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C=NC3=CC=CC=C32)C(=O)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C=NC3=CC=CC=C32)C(=O)N)Cl

InChI

InChI=1S/C18H16ClN3O2/c1-24-16-7-6-11(8-14(16)19)9-22-17-12-4-2-3-5-15(12)21-10-13(17)18(20)23/h2-8,10H,9H2,1H3,(H2,20,23)(H,21,22)