N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-yl-ethyl]-2-propan-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-yl-ethyl]-2-propan-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholino-ethyl]-2-isopropyl-quinoline-4-carboxamide CAS Name: N-[2-(4-ethoxy-3-methoxyphenyl)-2-(4-morpholinyl)ethyl]-2-propan-2-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(4-ethoxy-3-methoxyphenyl)-2-morpholin-4-ylethyl]-2-propan-2-ylquinoline-4-carboxamide Traditional Name: N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholino-ethyl]-2-isopropyl-cinchoninamide Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CNC(=O)C2=CC(=NC3=CC=CC=C32)C(C)C)N4CCOCC4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(CNC(=O)C2=CC(=NC3=CC=CC=C32)C(C)C)N4CCOCC4)OC

InChI

InChI=1S/C28H35N3O4/c1-5-35-26-11-10-20(16-27(26)33-4)25(31-12-14-34-15-13-31)18-29-28(32)22-17-24(19(2)3)30-23-9-7-6-8-21(22)23/h6-11,16-17,19,25H,5,12-15,18H2,1-4H3,(H,29,32)