N-(2-ethylphenyl)-N-methyl-1-morpholin-4-yl-isoquinoline-4-carboxamide

Systemtic Name: N-(2-ethylphenyl)-N-methyl-1-morpholin-4-yl-isoquinoline-4-carboxamide Openeye Name: N-(2-ethylphenyl)-N-methyl-1-morpholino-isoquinoline-4-carboxamide CAS Name: N-(2-ethylphenyl)-N-methyl-1-(4-morpholinyl)-4-isoquinolinecarboxamide IUPAC Name: N-(2-ethylphenyl)-N-methyl-1-morpholin-4-ylisoquinoline-4-carboxamide Traditional Name: N-(2-ethylphenyl)-N-methyl-1-morpholino-isoquinoline-4-carboxamide Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(C)C(=O)C2=CN=C(C3=CC=CC=C32)N4CCOCC4

Isomeric SMILES

CCC1=CC=CC=C1N(C)C(=O)C2=CN=C(C3=CC=CC=C32)N4CCOCC4

InChI

InChI=1S/C23H25N3O2/c1-3-17-8-4-7-11-21(17)25(2)23(27)20-16-24-22(26-12-14-28-15-13-26)19-10-6-5-9-18(19)20/h4-11,16H,3,12-15H2,1-2H3