methyl 1-(3-morpholin-4-ylpropylamino)isoquinoline-4-carboxylate

Systemtic Name: methyl 1-(3-morpholin-4-ylpropylamino)isoquinoline-4-carboxylate Openeye Name: methyl 1-(3-morpholinopropylamino)isoquinoline-4-carboxylate CAS Name: 1-[3-(4-morpholinyl)propylamino]-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-morpholin-4-ylpropylamino)isoquinoline-4-carboxylate Traditional Name: 1-(3-morpholinopropylamino)isoquinoline-4-carboxylic acid methyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C2=CC=CC=C21)NCCCN3CCOCC3

Isomeric SMILES

COC(=O)C1=CN=C(C2=CC=CC=C21)NCCCN3CCOCC3

InChI

InChI=1S/C18H23N3O3/c1-23-18(22)16-13-20-17(15-6-3-2-5-14(15)16)19-7-4-8-21-9-11-24-12-10-21/h2-3,5-6,13H,4,7-12H2,1H3,(H,19,20)