N-(3-ethylphenyl)-1-morpholin-4-yl-isoquinoline-4-carboxamide

Systemtic Name: N-(3-ethylphenyl)-1-morpholin-4-yl-isoquinoline-4-carboxamide Openeye Name: N-(3-ethylphenyl)-1-morpholino-isoquinoline-4-carboxamide CAS Name: N-(3-ethylphenyl)-1-(4-morpholinyl)-4-isoquinolinecarboxamide IUPAC Name: N-(3-ethylphenyl)-1-morpholin-4-ylisoquinoline-4-carboxamide Traditional Name: N-(3-ethylphenyl)-1-morpholino-isoquinoline-4-carboxamide Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)C2=CN=C(C3=CC=CC=C32)N4CCOCC4

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)C2=CN=C(C3=CC=CC=C32)N4CCOCC4

InChI

InChI=1S/C22H23N3O2/c1-2-16-6-5-7-17(14-16)24-22(26)20-15-23-21(25-10-12-27-13-11-25)19-9-4-3-8-18(19)20/h3-9,14-15H,2,10-13H2,1H3,(H,24,26)